ChemLookup

Friday, July 1, 2011

http://ChemLookup.com Compounds

CAS RN: 93919-37-0
CAS Name: (2S,3R,4S,5R)-2,4,5-tri(tetradecoxy)hexane-1,3,6-triol
OPENEYE Name: (2S,3R,4S,5R)-2,4,5-tri(tetradecoxy)hexane-1,3,6-triol
IUPAC Name: (2S,3R,4S,5R)-2,4,5-tri(tetradecoxy)hexane-1,3,6-triol
SYSTEMATIC NAME: (2S,3R,4S,5R)-2,4,5-tri(tetradecoxy)hexane-1,3,6-triol
MOLECULAR FORMULA: C48H98O6
MOLECULAR WEIGHT: 771.28812
SMILES: CCCCCCCCCCCCCCO[C@@H](CO)[C@H]([C@@H]([C@@H](CO)OCCCCCCCCCCCCCC)OCCCCCCCCCCCCCC)O

CAS RN: 175521-91-2
CAS Name: 2-amino-3-hydroxy-2-(hydroxymethyl)-14-oxoeicosanoic acid
OPENEYE Name: 2-amino-3-hydroxy-2-(hydroxymethyl)-14-oxo-icosanoic acid
IUPAC Name: 2-amino-3-hydroxy-2-(hydroxymethyl)-14-oxoicosanoic acid
SYSTEMATIC NAME: 2-azanyl-2-(hydroxymethyl)-3-oxidanyl-14-oxidanylidene-icosanoic acid
MOLECULAR FORMULA: C21H41NO5
MOLECULAR WEIGHT: 387.55394
SMILES: CCCCCCC(=O)CCCCCCCCCCC(C(CO)(C(=O)O)N)O

CAS RN: 93803-57-7
CAS Name: 2-cyclooctyl-6-[(3-cyclooctyl-2-hydroxy-5-propan-2-ylphenyl)methyl]-4-propan-2-ylphenol
OPENEYE Name: 2-cyclooctyl-6-[(3-cyclooctyl-2-hydroxy-5-isopropyl-phenyl)methyl]-4-isopropyl-phenol
IUPAC Name: 2-cyclooctyl-6-[(3-cyclooctyl-2-hydroxy-5-propan-2-ylphenyl)methyl]-4-propan-2-ylphenol
SYSTEMATIC NAME: 2-cyclooctyl-6-[(3-cyclooctyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]-4-propan-2-yl-phenol
MOLECULAR FORMULA: C35H52O2
MOLECULAR WEIGHT: 504.78618
SMILES: CC(C)C1=CC(=C(C(=C1)C2CCCCCCC2)O)CC3=C(C(=CC(=C3)C(C)C)C4CCCCCCC4)O

CAS RN: 93964-68-2
CAS Name: 3-[5-[bis(phenylmethyl)amino]-2-methoxyphenyl]-3-[4-(diethylamino)-2-hydroxyphenyl]-1-isobenzofuranone
OPENEYE Name: 3-[5-(dibenzylamino)-2-methoxy-phenyl]-3-[4-(diethylamino)-2-hydroxy-phenyl]isobenzofuran-1-one
IUPAC Name: 3-[5-(dibenzylamino)-2-methoxyphenyl]-3-[4-(diethylamino)-2-hydroxyphenyl]-2-benzofuran-1-one
SYSTEMATIC NAME: 3-[5-[bis(phenylmethyl)amino]-2-methoxy-phenyl]-3-[4-(diethylamino)-2-oxidanyl-phenyl]-2-benzofuran-1-one
MOLECULAR FORMULA: C39H38N2O4
MOLECULAR WEIGHT: 598.73002
SMILES: CCN(CC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=C(C=CC(=C4)N(CC5=CC=CC=C5)CC6=CC=CC=C6)OC)O

CAS RN: 74319-87-2
CAS Name: sodium 2-amino-4,5-dimethylbenzenesulfonate
OPENEYE Name: sodium 2-amino-4,5-dimethyl-benzenesulfonate
IUPAC Name: sodium 2-amino-4,5-dimethylbenzenesulfonate
SYSTEMATIC NAME: sodium 2-azanyl-4,5-dimethyl-benzenesulfonate
MOLECULAR FORMULA: C8H10NNaO3S
MOLECULAR WEIGHT: 223.22467
SMILES: CC1=CC(=C(C=C1C)S(=O)(=O)[O-])N.[Na+]

CAS RN: 125328-79-2
CAS Name: calcium (5-bromo-4-chloro-1H-indol-3-yl) phosphate
OPENEYE Name: calcium (5-bromo-4-chloro-1H-indol-3-yl) phosphate
IUPAC Name: calcium (5-bromo-4-chloro-1H-indol-3-yl) phosphate
SYSTEMATIC NAME: calcium (5-bromanyl-4-chloranyl-1H-indol-3-yl) phosphate
MOLECULAR FORMULA: C8H4BrCaClNO4P
MOLECULAR WEIGHT: 364.530421
SMILES: C1=CC(=C(C2=C1NC=C2OP(=O)([O-])[O-])Cl)Br.[Ca+2]

CAS RN: 97171-90-9
CAS Name: dihydroxy(dioxo)tungsten; 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-9-xanthenyl]benzoic acid ethyl ester
OPENEYE Name: dihydroxy(dioxo)tungsten; ethyl 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzoate
IUPAC Name: dihydroxy(dioxo)tungsten; ethyl 2-[3-(ethylamino)-6-ethylimino-2,7-dimethylxanthen-9-yl]benzoate
SYSTEMATIC NAME: bis(oxidanyl)-bis(oxidanylidene)tungsten; ethyl 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzoate
MOLECULAR FORMULA: C28H32N2O7W
MOLECULAR WEIGHT: 692.40288
SMILES: CCNC1=C(C=C2C(=C1)OC3=CC(=NCC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.O[W](=O)(=O)O

CAS RN: 77259-34-8
CAS Name: diammonium tetrabromoplatinum(2-)
OPENEYE Name: diammonium tetrabromoplatinum(2-)
IUPAC Name: diazanium tetrabromoplatinum(2-)
SYSTEMATIC NAME: diazanium tetrakis(bromanyl)platinum(2-)
MOLECULAR FORMULA: Br4H8N2Pt
MOLECULAR WEIGHT: 550.77092
SMILES: [NH4+].[NH4+].Br[Pt-2](Br)(Br)Br

CAS RN: 94247-82-2
CAS Name: 3-(3-methylbutyl)-1-benzopyran-2-one
OPENEYE Name: 3-isopentylchromen-2-one
IUPAC Name: 3-(3-methylbutyl)chromen-2-one
SYSTEMATIC NAME: 3-(3-methylbutyl)chromen-2-one
MOLECULAR FORMULA: C14H16O2
MOLECULAR WEIGHT: 216.27564
SMILES: CC(C)CCC1=CC2=CC=CC=C2OC1=O

CAS RN: 72765-55-0
CAS Name: 2,4-dihydroxy-4-oxobutanoate; 4-methyl-3-(4-phenyldiazenylphenyl)azo-5-(1-pyridin-1-iumyl)-3H-pyridine-2,6-dione
OPENEYE Name: 2,4-dihydroxy-4-oxo-butanoate; 4-methyl-3-(4-phenylazophenyl)azo-5-pyridin-1-ium-1-yl-3H-pyridine-2,6-dione
IUPAC Name: 2,4-dihydroxy-4-oxobutanoate; 4-methyl-3-[(4-phenyldiazenylphenyl)diazenyl]-5-pyridin-1-ium-1-yl-3H-pyridine-2,6-dione
SYSTEMATIC NAME: 2,4-bis(oxidanyl)-4-oxidanylidene-butanoate; 4-methyl-3-[(4-phenyldiazenylphenyl)diazenyl]-5-pyridin-1-ium-1-yl-3H-pyridine-2,6-dione
MOLECULAR FORMULA: C27H24N6O7
MOLECULAR WEIGHT: 544.51546
SMILES: CC1=C(C(=O)NC(=O)C1N=NC2=CC=C(C=C2)N=NC3=CC=CC=C3)[N+]4=CC=CC=C4.C(C(C(=O)[O-])O)C(=O)O

CAS RN: 94481-49-9
CAS Name: barium(2+); 2,2-dimethylhexanoate
OPENEYE Name: barium(2+); 2,2-dimethylhexanoate
IUPAC Name: barium(2+); 2,2-dimethylhexanoate
SYSTEMATIC NAME: barium(2+); 2,2-dimethylhexanoate
MOLECULAR FORMULA: C16H30BaO4
MOLECULAR WEIGHT: 423.734
SMILES: CCCCC(C)(C)C(=O)[O-].CCCCC(C)(C)C(=O)[O-].[Ba+2]

CAS RN: 127179-40-2
CAS Name: 4-[[2-[2-chloro-4-[3-chloro-4-[1,3-dioxo-1-(4-sulfonatoanilino)butan-2-yl]azophenyl]phenyl]azo-1,3-dioxobutyl]amino]benzenesulfonate; dimethyl(dioctadecyl)ammonium
OPENEYE Name: 4-[[2-[2-chloro-4-[3-chloro-4-[2-oxo-1-[(4-sulfonatophenyl)carbamoyl]propyl]azo-phenyl]phenyl]azo-3-oxo-butanoyl]amino]benzenesulfonate; dimethyl(dioctadecyl)ammonium
IUPAC Name: 4-[[2-[[2-chloro-4-[3-chloro-4-[[1,3-dioxo-1-(4-sulfonatoanilino)butan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-3-oxobutanoyl]amino]benzenesulfonate; dimethyl(dioctadecyl)azanium
SYSTEMATIC NAME: 4-[[2-[[4-[4-[[1,3-bis(oxidanylidene)-1-[(4-sulfonatophenyl)amino]butan-2-yl]diazenyl]-3-chloranyl-phenyl]-2-chloranyl-phenyl]diazenyl]-3-oxidanylidene-butanoyl]amino]benzenesulfonate; dimethyl(dioctadecyl)azanium
MOLECULAR FORMULA: C108H184Cl2N8O10S2
MOLECULAR WEIGHT: 1889.70016
SMILES: CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.CC(=O)C(C(=O)NC1=CC=C(C=C1)S(=O)(=O)[O-])N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=C(C=C4)S(=O)(=O)[O-])Cl)Cl

CAS RN: 94200-28-9
CAS Name: 2,4-dimethyl-6-(2,2,3-trimethyl-1-cyclopent-3-enyl)-1-hexanol
OPENEYE Name: 2,4-dimethyl-6-(2,2,3-trimethylcyclopent-3-en-1-yl)hexan-1-ol
IUPAC Name: 2,4-dimethyl-6-(2,2,3-trimethylcyclopent-3-en-1-yl)hexan-1-ol
SYSTEMATIC NAME: 2,4-dimethyl-6-(2,2,3-trimethylcyclopent-3-en-1-yl)hexan-1-ol
MOLECULAR FORMULA: C16H30O
MOLECULAR WEIGHT: 238.4088
SMILES: CC1=CCC(C1(C)C)CCC(C)CC(C)CO

http://ChemLookup.com Compounds

CAS RN: 93893-51-7
CAS Name: acetic acid 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)ethyl ester
OPENEYE Name: 2-decalin-1-ylethyl acetate
IUPAC Name: 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)ethyl acetate
SYSTEMATIC NAME: 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)ethyl ethanoate
MOLECULAR FORMULA: C14H24O2
MOLECULAR WEIGHT: 224.33916
SMILES: CC(=O)OCCC1CCCC2C1CCCC2

CAS RN: 117187-51-6
CAS Name: (2Z)-2-ethylidene-5-methoxybicyclo[2.2.1]heptane
OPENEYE Name: (2Z)-2-ethylidene-5-methoxy-norbornane
IUPAC Name: (2Z)-2-ethylidene-5-methoxybicyclo[2.2.1]heptane
SYSTEMATIC NAME: (2Z)-2-ethylidene-5-methoxy-bicyclo[2.2.1]heptane
MOLECULAR FORMULA: C10H16O
MOLECULAR WEIGHT: 152.23344
SMILES: C/C=C\1/CC2CC1CC2OC

CAS RN: 71426-97-6
CAS Name: 1,1-dichloroethene; 2-propenoic acid butyl ester; 2-propenoic acid 2-ethoxyethyl ester
OPENEYE Name: butyl prop-2-enoate; 1,1-dichloroethylene; 2-ethoxyethyl prop-2-enoate
IUPAC Name: butyl prop-2-enoate; 1,1-dichloroethene; 2-ethoxyethyl prop-2-enoate
SYSTEMATIC NAME: 1,1-bis(chloranyl)ethene; butyl prop-2-enoate; 2-ethoxyethyl prop-2-enoate
MOLECULAR FORMULA: C16H26Cl2O5
MOLECULAR WEIGHT: 369.28064
SMILES: CCCCOC(=O)C=C.CCOCCOC(=O)C=C.C=C(Cl)Cl

CAS RN: 24411-12-9
CAS Name: ammonium iron(3+) tetrachloride
OPENEYE Name: ammonium ferric tetrachloride
IUPAC Name: azanium iron(3+) tetrachloride
SYSTEMATIC NAME: azanium iron(3+) tetrachloride
MOLECULAR FORMULA: Cl4FeH4N
MOLECULAR WEIGHT: 215.69546
SMILES: [NH4+].[Cl-].[Cl-].[Cl-].[Cl-].[Fe+3]

CAS RN: 85940-53-0
CAS Name: 4-chloro-2-(phenylmethyl)phenolate; ethyl-hexadecyl-dimethylammonium
OPENEYE Name: 2-benzyl-4-chloro-phenolate; ethyl-hexadecyl-dimethyl-ammonium
IUPAC Name: 2-benzyl-4-chlorophenolate; ethyl-hexadecyl-dimethylazanium
SYSTEMATIC NAME: 4-chloranyl-2-(phenylmethyl)phenolate; ethyl-hexadecyl-dimethyl-azanium
MOLECULAR FORMULA: C33H54ClNO
MOLECULAR WEIGHT: 516.24096
SMILES: CCCCCCCCCCCCCCCC[N+](C)(C)CC.C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)[O-]

CAS RN: 167078-09-3
CAS Name: 2-(dimethylamino)-2-methyl-1-propanol; 2-propenoic acid
OPENEYE Name: acrylic acid; 2-(dimethylamino)-2-methyl-propan-1-ol
IUPAC Name: 2-(dimethylamino)-2-methylpropan-1-ol; prop-2-enoic acid
SYSTEMATIC NAME: 2-(dimethylamino)-2-methyl-propan-1-ol; prop-2-enoic acid
MOLECULAR FORMULA: C9H19NO3
MOLECULAR WEIGHT: 189.25206
SMILES: CC(C)(CO)N(C)C.C=CC(=O)O

CAS RN: 85204-18-8
CAS Name: acetic acid 1-(3,3-dimethyl-2-bicyclo[2.2.1]hept-5-enyl)ethyl ester
OPENEYE Name: 1-(3,3-dimethyl-2-bicyclo[2.2.1]hept-5-enyl)ethyl acetate
IUPAC Name: 1-(3,3-dimethyl-2-bicyclo[2.2.1]hept-5-enyl)ethyl acetate
SYSTEMATIC NAME: 1-(3,3-dimethyl-2-bicyclo[2.2.1]hept-5-enyl)ethyl ethanoate
MOLECULAR FORMULA: C13H20O2
MOLECULAR WEIGHT: 208.2967
SMILES: CC(C1C2CC(C1(C)C)C=C2)OC(=O)C

CAS RN: 72088-91-6
CAS Name: 2-chloro-2-propenoic acid tert-butyl ester; 2-chloro-2-propenoic acid ethyl ester
OPENEYE Name: tert-butyl 2-chloroprop-2-enoate; ethyl 2-chloroprop-2-enoate
IUPAC Name: tert-butyl 2-chloroprop-2-enoate; ethyl 2-chloroprop-2-enoate
SYSTEMATIC NAME: tert-butyl 2-chloranylprop-2-enoate; ethyl 2-chloranylprop-2-enoate
MOLECULAR FORMULA: C12H18Cl2O4
MOLECULAR WEIGHT: 297.17492
SMILES: CCOC(=O)C(=C)Cl.CC(C)(C)OC(=O)C(=C)Cl

CAS RN: 94022-71-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C54H40Cl2N18O26S8
MOLECULAR WEIGHT: 1684.4264
SMILES: C1=CC(=C(C=C1NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)N=NC4=C(C=C5C=C(C=C(C5=C4)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)NC(=O)N)Cl)S(=O)(=O)O)/C=C/C6=C(C=C(C=C6)NC7=NC(=NC(=N7)NC8=CC(=C(C=C8)N=NC9=C(C=C1C=C(C=C(C1=C9)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)NC(=O)N)Cl)S(=O)(=O)O

CAS RN: 151085-82-4
CAS Name: potassium (3E)-3-[[4-[[[4-[(2Z)-2-(3-carboxylato-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]anilino]-oxomethyl]amino]phenyl]hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxylate
OPENEYE Name: potassium (3E)-3-[[4-[[4-[(2Z)-2-(3-carboxylato-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]phenyl]carbamoylamino]phenyl]hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylate
IUPAC Name: potassium (3E)-3-[[4-[[4-[(2Z)-2-(3-carboxylato-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]carbamoylamino]phenyl]hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylate
SYSTEMATIC NAME: potassium (3E)-3-[[4-[[4-[(2Z)-2-(3-carboxylato-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]carbamoylamino]phenyl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylate
MOLECULAR FORMULA: C27H18KN6O7-
MOLECULAR WEIGHT: 577.56612
SMILES: C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)N/N=C\3/C=CC(=O)C(=C3)C(=O)[O-])N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-].[K+]

CAS RN: 74559-56-1
CAS Name: butane-1,1-diol; 2-methyl-2-propenoic acid
OPENEYE Name: butane-1,1-diol; 2-methylprop-2-enoic acid
IUPAC Name: butane-1,1-diol; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: butane-1,1-diol; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C8H16O4
MOLECULAR WEIGHT: 176.21024
SMILES: CCCC(O)O.CC(=C)C(=O)O

CAS RN: 94279-10-4
CAS Name: 8-methylnonanoic acid [3-hydroxy-2-(4-methylphenyl)sulfonyloxypropyl] ester
OPENEYE Name: [3-hydroxy-2-(p-tolylsulfonyloxy)propyl] 8-methylnonanoate
IUPAC Name: [3-hydroxy-2-(4-methylphenyl)sulfonyloxypropyl] 8-methylnonanoate
SYSTEMATIC NAME: [2-(4-methylphenyl)sulfonyloxy-3-oxidanyl-propyl] 8-methylnonanoate
MOLECULAR FORMULA: C20H32O6S
MOLECULAR WEIGHT: 400.52948
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC(CO)COC(=O)CCCCCCC(C)C

CAS RN: 93981-73-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C42H24ClN3O6
MOLECULAR WEIGHT: 702.10946
SMILES: C1C=CC2=C(C1=O)CC3=C4C(=CC(=O)C3=C2)C5=CC(=O)C6C(=C5N4Cl)C=C7CC=C8C(=C7N6)C(=O)C9=C(C8=O)C(=CC=C9)NC(=O)C1=CC=CC=C1

CAS RN: 72987-50-9
CAS Name: 6-[3-(4,6-diamino-1,3,5-triazin-2-yl)-2-methylpropyl]-1,3,5-triazine-2,4-diamine; formaldehyde
OPENEYE Name: 6-[3-(4,6-diamino-1,3,5-triazin-2-yl)-2-methyl-propyl]-1,3,5-triazine-2,4-diamine; formaldehyde
IUPAC Name: 6-[3-(4,6-diamino-1,3,5-triazin-2-yl)-2-methylpropyl]-1,3,5-triazine-2,4-diamine; formaldehyde
SYSTEMATIC NAME: 6-[3-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]-2-methyl-propyl]-1,3,5-triazine-2,4-diamine; methanal
MOLECULAR FORMULA: C11H18N10O
MOLECULAR WEIGHT: 306.32702
SMILES: CC(CC1=NC(=NC(=N1)N)N)CC2=NC(=NC(=N2)N)N.C=O

CAS RN: 93857-39-7
CAS Name: benzenesulfonic acid; 2-(dimethylamino)ethanol
OPENEYE Name: benzenesulfonic acid; 2-(dimethylamino)ethanol
IUPAC Name: benzenesulfonic acid; 2-(dimethylamino)ethanol
SYSTEMATIC NAME: benzenesulfonic acid; 2-(dimethylamino)ethanol
MOLECULAR FORMULA: C10H17NO4S
MOLECULAR WEIGHT: 247.31128
SMILES: CN(C)CCO.C1=CC=C(C=C1)S(=O)(=O)O

CAS RN: 132435-10-0
CAS Name: 2-(2-hydroxyethoxy)ethanol; 2-methyloxirane
OPENEYE Name: 2-(2-hydroxyethoxy)ethanol; 2-methyloxirane
IUPAC Name: 2-(2-hydroxyethoxy)ethanol; 2-methyloxirane
SYSTEMATIC NAME: 2-(2-hydroxyethyloxy)ethanol; 2-methyloxirane
MOLECULAR FORMULA: C7H16O4
MOLECULAR WEIGHT: 164.19954
SMILES: CC1CO1.C(COCCO)O

CAS RN: 71215-93-5
CAS Name: sodium 3-(ethoxycarbonylamino)benzenesulfonate
OPENEYE Name: sodium 3-(ethoxycarbonylamino)benzenesulfonate
IUPAC Name: sodium 3-(ethoxycarbonylamino)benzenesulfonate
SYSTEMATIC NAME: sodium 3-(ethoxycarbonylamino)benzenesulfonate
MOLECULAR FORMULA: C9H10NNaO5S
MOLECULAR WEIGHT: 267.23417
SMILES: CCOC(=O)NC1=CC(=CC=C1)S(=O)(=O)[O-].[Na+]

CAS RN: 93843-22-2
CAS Name: 17-methyloctadecanal
OPENEYE Name: 17-methyloctadecanal
IUPAC Name: 17-methyloctadecanal
SYSTEMATIC NAME: 17-methyloctadecanal
MOLECULAR FORMULA: C19H38O
MOLECULAR WEIGHT: 282.50442
SMILES: CC(C)CCCCCCCCCCCCCCCC=O

CAS RN: 12043-90-2
CAS Name: decaaluminum; lanthanum(3+); oxygen(2-)
OPENEYE Name: decaaluminum; lanthanum(3+); oxygen(2-)
IUPAC Name: decaaluminum; lanthanum(3+); oxygen(2-)
SYSTEMATIC NAME: decaaluminum; lanthanum(3+); oxygen(2-)
MOLECULAR FORMULA: Al10LaO18-3
MOLECULAR WEIGHT: 696.71008
SMILES: [O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[La+3]

CAS RN: 93803-32-8
CAS Name: trisodium 4-[(2Z)-2-[8-[[3-(benzenesulfonyl)-1-oxopropyl]amino]-1-oxo-3,6-disulfonato-2-naphthalenylidene]hydrazinyl]benzoate
OPENEYE Name: trisodium 4-[(2Z)-2-[8-[3-(benzenesulfonyl)propanoylamino]-1-oxo-3,6-disulfonato-2-naphthylidene]hydrazino]benzoate
IUPAC Name: trisodium 4-[(2Z)-2-[8-[3-(benzenesulfonyl)propanoylamino]-1-oxo-3,6-disulfonatonaphthalen-2-ylidene]hydrazinyl]benzoate
SYSTEMATIC NAME: trisodium 4-[(2Z)-2-[1-oxidanylidene-8-[3-(phenylsulfonyl)propanoylamino]-3,6-disulfonato-naphthalen-2-ylidene]hydrazinyl]benzoate
MOLECULAR FORMULA: C26H18N3Na3O12S3
MOLECULAR WEIGHT: 729.59833
SMILES: C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N\NC4=CC=C(C=C4)C(=O)[O-])/C3=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]

CAS RN: 13108-53-7
CAS Name: 2,3,5,6-tetrachloro-4-ethylsulfonylpyridine
OPENEYE Name: 2,3,5,6-tetrachloro-4-ethylsulfonyl-pyridine
IUPAC Name: 2,3,5,6-tetrachloro-4-ethylsulfonylpyridine
SYSTEMATIC NAME: 2,3,5,6-tetrakis(chloranyl)-4-ethylsulfonyl-pyridine
MOLECULAR FORMULA: C7H5Cl4NO2S
MOLECULAR WEIGHT: 308.9971
SMILES: CCS(=O)(=O)C1=C(C(=NC(=C1Cl)Cl)Cl)Cl

CAS RN: 84029-91-4
CAS Name: 6-methoxy-2,2,6,9-tetramethylbicyclo[3.3.1]nonane
OPENEYE Name: 6-methoxy-2,2,6,9-tetramethyl-bicyclo[3.3.1]nonane
IUPAC Name: 6-methoxy-2,2,6,9-tetramethylbicyclo[3.3.1]nonane
SYSTEMATIC NAME: 6-methoxy-2,2,6,9-tetramethyl-bicyclo[3.3.1]nonane
MOLECULAR FORMULA: C14H26O
MOLECULAR WEIGHT: 210.35564
SMILES: CC1C2CCC(C1CCC2(C)C)(C)OC

CAS RN: 14047-57-5
CAS Name: sodium 10-hydroxy-10-oxodecanoate
OPENEYE Name: sodium 10-hydroxy-10-oxo-decanoate
IUPAC Name: sodium 10-hydroxy-10-oxodecanoate
SYSTEMATIC NAME: sodium 10-oxidanyl-10-oxidanylidene-decanoate
MOLECULAR FORMULA: C10H17NaO4
MOLECULAR WEIGHT: 224.22935
SMILES: C(CCCCC(=O)[O-])CCCC(=O)O.[Na+]

CAS RN: 85030-34-8
CAS Name: 1-[butyl-[3-[4-[(E)-2-[4-(diethylamino)phenyl]ethenyl]-1-pyridin-1-iumyl]-2-hydroxypropyl]amino]-3-[4-[(E)-2-[4-(diethylamino)phenyl]ethenyl]-1-pyridin-1-iumyl]-2-propanol dichloride
OPENEYE Name: 1-[butyl-[3-[4-[(E)-2-[4-(diethylamino)phenyl]vinyl]pyridin-1-ium-1-yl]-2-hydroxy-propyl]amino]-3-[4-[(E)-2-[4-(diethylamino)phenyl]vinyl]pyridin-1-ium-1-yl]propan-2-ol dichloride
IUPAC Name: 1-[butyl-[3-[4-[(E)-2-[4-(diethylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]-2-hydroxypropyl]amino]-3-[4-[(E)-2-[4-(diethylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propan-2-ol dichloride
SYSTEMATIC NAME: 1-[butyl-[3-[4-[(E)-2-[4-(diethylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]-2-oxidanyl-propyl]amino]-3-[4-[(E)-2-[4-(diethylamino)phenyl]ethenyl]pyridin-1-ium-1-yl]propan-2-ol dichloride
MOLECULAR FORMULA: C44H61Cl2N5O2
MOLECULAR WEIGHT: 762.89344
SMILES: CCCCN(CC(O)C[N+]1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)N(CC)CC)CC(O)C[N+]3=CC=C(C=C3)/C=C/C4=CC=C(C=C4)N(CC)CC.[Cl-].[Cl-]

CAS RN: 15684-00-1
CAS Name: methanone; rhenium
OPENEYE Name: methanone; rhenium
IUPAC Name: methanone; rhenium
SYSTEMATIC NAME: methanone; rhenium
MOLECULAR FORMULA: C5H5O5Re-5
MOLECULAR WEIGHT: 331.2972
SMILES: [CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[Re]

http://ChemLookup.com Compounds

CAS RN: 93803-19-1
CAS Name: [2-hydroxy-3-(1-oxoeicosylamino)-3-(1-oxooctadecoxy)propyl]-dimethyl-propylammonium chloride
OPENEYE Name: [2-hydroxy-3-(icosanoylamino)-3-octadecanoyloxy-propyl]-dimethyl-propyl-ammonium chloride
IUPAC Name: [2-hydroxy-3-(icosanoylamino)-3-octadecanoyloxypropyl]-dimethyl-propylazanium chloride
SYSTEMATIC NAME: [3-(icosanoylamino)-3-octadecanoyloxy-2-oxidanyl-propyl]-dimethyl-propyl-azanium chloride
MOLECULAR FORMULA: C46H93ClN2O4
MOLECULAR WEIGHT: 773.69462
SMILES: CCCCCCCCCCCCCCCCCCCC(=O)NC(C(C[N+](C)(C)CCC)O)OC(=O)CCCCCCCCCCCCCCCCC.[Cl-]

CAS RN: 72854-09-2
CAS Name: tetrasodium 2-[(E)-2-[4-[oxido-[4-[oxido-(4-sulfonatophenyl)iminoammonio]phenyl]iminoammonio]-2-sulfonatophenyl]ethenyl]-5-[4-[oxido-(4-sulfonatophenyl)iminoammonio]phenyl]azobenzenesulfonate
OPENEYE Name: tetrasodium 2-[(E)-2-[4-[oxido-[4-[oxido-(4-sulfonatophenyl)imino-ammonio]phenyl]imino-ammonio]-2-sulfonato-phenyl]vinyl]-5-[4-[oxido-(4-sulfonatophenyl)imino-ammonio]phenyl]azo-benzenesulfonate
IUPAC Name: tetrasodium 2-[(E)-2-[4-[oxido-[4-[oxido-(4-sulfonatophenyl)iminoazaniumyl]phenyl]iminoazaniumyl]-2-sulfonatophenyl]ethenyl]-5-[[4-[oxido-(4-sulfonatophenyl)iminoazaniumyl]phenyl]diazenyl]benzenesulfonate
SYSTEMATIC NAME: tetrasodium 2-[(E)-2-[4-[oxidanidyl-[4-[oxidanidyl-(4-sulfonatophenyl)imino-azaniumyl]phenyl]imino-azaniumyl]-2-sulfonato-phenyl]ethenyl]-5-[[4-[oxidanidyl-(4-sulfonatophenyl)imino-azaniumyl]phenyl]diazenyl]benzenesulfonate
MOLECULAR FORMULA: C38H24N8Na4O15S4
MOLECULAR WEIGHT: 1052.86084
SMILES: C1=CC(=CC=C1N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)[N+](=NC4=CC=C(C=C4)[N+](=NC5=CC=C(C=C5)S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]

CAS RN: 73398-30-8
CAS Name: disodium 3-[3-[[9,10-dioxo-4-[4-(3-sulfonatophenyl)butan-2-ylamino]-1-anthracenyl]amino]butyl]benzenesulfonate
OPENEYE Name: disodium 3-[3-[[4-[[1-methyl-3-(3-sulfonatophenyl)propyl]amino]-9,10-dioxo-1-anthryl]amino]butyl]benzenesulfonate
IUPAC Name: disodium 3-[3-[[9,10-dioxo-4-[4-(3-sulfonatophenyl)butan-2-ylamino]anthracen-1-yl]amino]butyl]benzenesulfonate
SYSTEMATIC NAME: disodium 3-[3-[[9,10-bis(oxidanylidene)-4-[4-(3-sulfonatophenyl)butan-2-ylamino]anthracen-1-yl]amino]butyl]benzenesulfonate
MOLECULAR FORMULA: C34H32N2Na2O8S2
MOLECULAR WEIGHT: 706.73602
SMILES: CC(CCC1=CC(=CC=C1)S(=O)(=O)[O-])NC2=C3C(=C(C=C2)NC(C)CCC4=CC(=CC=C4)S(=O)(=O)[O-])C(=O)C5=CC=CC=C5C3=O.[Na+].[Na+]

CAS RN: 83006-67-1
CAS Name: disodium 5-tert-butyl-2-[[4-(4-tert-butyl-2-sulfonatoanilino)-5,8-dihydroxy-9,10-dioxo-1-anthracenyl]amino]benzenesulfonate
OPENEYE Name: disodium 5-tert-butyl-2-[[4-(4-tert-butyl-2-sulfonato-anilino)-5,8-dihydroxy-9,10-dioxo-1-anthryl]amino]benzenesulfonate
IUPAC Name: disodium 5-tert-butyl-2-[[4-(4-tert-butyl-2-sulfonatoanilino)-5,8-dihydroxy-9,10-dioxoanthracen-1-yl]amino]benzenesulfonate
SYSTEMATIC NAME: disodium 5-tert-butyl-2-[[4-[(4-tert-butyl-2-sulfonato-phenyl)amino]-5,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzenesulfonate
MOLECULAR FORMULA: C34H32N2Na2O10S2
MOLECULAR WEIGHT: 738.73482
SMILES: CC(C)(C)C1=CC(=C(C=C1)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4)C(C)(C)C)S(=O)(=O)[O-])C(=O)C5=C(C=CC(=C5C3=O)O)O)S(=O)(=O)[O-].[Na+].[Na+]

CAS RN: 93918-35-5
CAS Name: 2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)thio]acetic acid 2-[2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)thio]-1-oxoethoxy]ethyl ester
OPENEYE Name: 2-[2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)sulfanyl]acetyl]oxyethyl 2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)sulfanyl]acetate
IUPAC Name: 2-[2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)sulfanyl]acetyl]oxyethyl 2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)sulfanyl]acetate
SYSTEMATIC NAME: 2-[2-[[5-octyl-2,8-bis(oxidanylidene)-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl]sulfanyl]ethanoyloxy]ethyl 2-[[5-octyl-2,8-bis(oxidanylidene)-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl]sulfanyl]ethanoate
MOLECULAR FORMULA: C34H58O12S6Sn2
MOLECULAR WEIGHT: 1088.62712
SMILES: CCCCCCCC[Sn]1(SCC(=O)OCCOC(=O)CS1)SCC(=O)OCCOC(=O)CS[Sn]2(SCC(=O)OCCOC(=O)CS2)CCCCCCCC

CAS RN: 94096-31-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: C1CC2C(C1)C3CC2C(C3O)O

CAS RN: 94109-04-3
CAS Name: acetic acid; 4-(2-methoxy-5-methylphenyl)azo-3-methyl-5-oxo-4H-pyrazole-1-carboximidamide
OPENEYE Name: acetic acid; 4-(2-methoxy-5-methyl-phenyl)azo-3-methyl-5-oxo-4H-pyrazole-1-carboxamidine
IUPAC Name: acetic acid; 4-[(2-methoxy-5-methylphenyl)diazenyl]-3-methyl-5-oxo-4H-pyrazole-1-carboximidamide
SYSTEMATIC NAME: ethanoic acid; 4-[(2-methoxy-5-methyl-phenyl)diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazole-1-carboximidamide
MOLECULAR FORMULA: C15H20N6O4
MOLECULAR WEIGHT: 348.3571
SMILES: CC1=CC(=C(C=C1)OC)N=NC2C(=NN(C2=O)C(=N)N)C.CC(=O)O

CAS RN: 93803-44-2
CAS Name: 3-[[[3-(2-ethylhexoxy)-3-oxopropyl]thio]methylthio]propanoic acid 2-ethylhexyl ester
OPENEYE Name: 2-ethylhexyl 3-[[3-(2-ethylhexoxy)-3-oxo-propyl]sulfanylmethylsulfanyl]propanoate
IUPAC Name: 2-ethylhexyl 3-[[3-(2-ethylhexoxy)-3-oxopropyl]sulfanylmethylsulfanyl]propanoate
SYSTEMATIC NAME: 2-ethylhexyl 3-[[3-(2-ethylhexoxy)-3-oxidanylidene-propyl]sulfanylmethylsulfanyl]propanoate
MOLECULAR FORMULA: C23H44O4S2
MOLECULAR WEIGHT: 448.72306
SMILES: CCCCC(CC)COC(=O)CCSCSCCC(=O)OCC(CC)CCCC

CAS RN: 93919-85-8
CAS Name: sodium 2-[2-hydroxyethyl-[2-[[(Z)-1-oxooctadec-9-enyl]amino]ethyl]amino]acetate
OPENEYE Name: sodium 2-[2-hydroxyethyl-[2-[[(Z)-octadec-9-enoyl]amino]ethyl]amino]acetate
IUPAC Name: sodium 2-[2-hydroxyethyl-[2-[[(Z)-octadec-9-enoyl]amino]ethyl]amino]acetate
SYSTEMATIC NAME: sodium 2-[2-hydroxyethyl-[2-[[(Z)-octadec-9-enoyl]amino]ethyl]amino]ethanoate
MOLECULAR FORMULA: C24H45N2NaO4
MOLECULAR WEIGHT: 448.61487
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)NCCN(CCO)CC(=O)[O-].[Na+]

CAS RN: 93965-07-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C49H23N3O7
MOLECULAR WEIGHT: 765.72282
SMILES: C1C2=C(C3=C(C1=O)C4=C(N3)C5=C(C6=NC7=C8C=C9C=CC(=O)C=C9C=C8C=CC7=C46)C(=O)C1=CC=CC=C1C5=O)C(=O)C1=C(C2=O)C(=CC=C1)NC(=O)C1=CC=CC=C1

CAS RN: 39330-74-0
CAS Name: cyclopenta-1,3-diene; erbium(3+)
OPENEYE Name: cyclopenta-1,3-diene; erbium(3+)
IUPAC Name: cyclopenta-1,3-diene; erbium(3+)
SYSTEMATIC NAME: cyclopenta-1,3-diene; erbium(3+)
MOLECULAR FORMULA: C15H18Er+3
MOLECULAR WEIGHT: 365.56242
SMILES: C1C=CC=C1.C1C=CC=C1.C1C=CC=C1.[Er+3]

CAS RN: 83817-74-7
CAS Name: 2,6-dimethyloct-7-en-2-yloxy-dimethoxy-methylsilane
OPENEYE Name: dimethoxy-methyl-(1,1,5-trimethylhept-6-enoxy)silane
IUPAC Name: 2,6-dimethyloct-7-en-2-yloxy-dimethoxy-methylsilane
SYSTEMATIC NAME: 2,6-dimethyloct-7-en-2-yloxy-dimethoxy-methyl-silane
MOLECULAR FORMULA: C13H28O3Si
MOLECULAR WEIGHT: 260.44512
SMILES: CC(CCCC(C)(C)O[Si](C)(OC)OC)C=C

CAS RN: 77099-06-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C36H33NO8
MOLECULAR WEIGHT: 607.64912
SMILES: CC1=CC=C(C=C1)C(=O)O[C@@H]([C@@H](C(=O)[O-])OC(=O)C2=CC=C(C=C2)C)C(=O)O.CC12C3=CC=CC=C3CC([NH2+]1)C4=CC=CC=C24

CAS RN: 84682-06-4
CAS Name: 5-[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]azo-2-[4-[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]azo-2-sulfophenyl]benzenesulfonic acid
OPENEYE Name: 5-[1-[(2-chlorophenyl)carbamoyl]-2-oxo-propyl]azo-2-[4-[1-[(2-chlorophenyl)carbamoyl]-2-oxo-propyl]azo-2-sulfo-phenyl]benzenesulfonic acid
IUPAC Name: 5-[[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-[4-[[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-sulfophenyl]benzenesulfonic acid
SYSTEMATIC NAME: 5-[[1-[(2-chlorophenyl)amino]-1,3-bis(oxidanylidene)butan-2-yl]diazenyl]-2-[4-[[1-[(2-chlorophenyl)amino]-1,3-bis(oxidanylidene)butan-2-yl]diazenyl]-2-sulfo-phenyl]benzenesulfonic acid
MOLECULAR FORMULA: C32H26Cl2N6O10S2
MOLECULAR WEIGHT: 789.61904
SMILES: CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=CC=C4Cl)S(=O)(=O)O)S(=O)(=O)O

CAS RN: 85391-81-7
CAS Name: 2,4-dibutyl-2,4-bis(dodecylthio)-7-(ethylthio)-1,5-dioxa-3-thia-2,4-distannacycloundecane-6,11-dione
OPENEYE Name: 2,4-dibutyl-2,4-bis(dodecylsulfanyl)-7-ethylsulfanyl-1,5-dioxa-3-thia-2,4-distannacycloundecane-6,11-dione
IUPAC Name: 2,4-dibutyl-2,4-bis(dodecylsulfanyl)-7-ethylsulfanyl-1,5-dioxa-3-thia-2,4-distannacycloundecane-6,11-dione
SYSTEMATIC NAME: 2,4-dibutyl-2,4-bis(dodecylsulfanyl)-7-ethylsulfanyl-1,5-dioxa-3-thia-2,4-distannacycloundecane-6,11-dione
MOLECULAR FORMULA: C40H80O4S4Sn2
MOLECULAR WEIGHT: 990.7408
SMILES: CCCCCCCCCCCCS[Sn]1(OC(=O)CCCC(C(=O)O[Sn](S1)(CCCC)SCCCCCCCCCCCC)SCC)CCCC

CAS RN: 71889-57-1
CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; eicosanoic acid
OPENEYE Name: 2-[bis(2-hydroxyethyl)amino]ethanol; icosanoic acid
IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; icosanoic acid
SYSTEMATIC NAME: 2-[bis(2-hydroxyethyl)amino]ethanol; icosanoic acid
MOLECULAR FORMULA: C26H55NO5
MOLECULAR WEIGHT: 461.7186
SMILES: CCCCCCCCCCCCCCCCCCCC(=O)O.C(CO)N(CCO)CCO

CAS RN: 83249-55-2
CAS Name: tetrasodium 2-[2-acetamido-4-[[[3-acetamido-4-[2-sulfonato-4-(4-sulfonatophenyl)azophenyl]azoanilino]-oxomethyl]amino]phenyl]azo-5-(4-sulfonatophenyl)azobenzenesulfonate
OPENEYE Name: tetrasodium 2-[2-acetamido-4-[[3-acetamido-4-[2-sulfonato-4-(4-sulfonatophenyl)azo-phenyl]azo-phenyl]carbamoylamino]phenyl]azo-5-(4-sulfonatophenyl)azo-benzenesulfonate
IUPAC Name: tetrasodium 2-[[2-acetamido-4-[[3-acetamido-4-[[2-sulfonato-4-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]phenyl]carbamoylamino]phenyl]diazenyl]-5-[(4-sulfonatophenyl)diazenyl]benzenesulfonate
SYSTEMATIC NAME: tetrasodium 2-[[2-acetamido-4-[[3-acetamido-4-[[2-sulfonato-4-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]phenyl]carbamoylamino]phenyl]diazenyl]-5-[(4-sulfonatophenyl)diazenyl]benzenesulfonate
MOLECULAR FORMULA: C41H30N12Na4O15S4
MOLECULAR WEIGHT: 1150.96738
SMILES: CC(=O)NC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C)N=NC5=C(C=C(C=C5)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

CAS RN: 80044-11-7
CAS Name: ammonia; 2-(chloromethyl)oxirane; hydrochloride
OPENEYE Name: ammonia; 2-(chloromethyl)oxirane; hydrochloride
IUPAC Name: azane; 2-(chloromethyl)oxirane; hydrochloride
SYSTEMATIC NAME: azane; 2-(chloromethyl)oxirane; hydrochloride
MOLECULAR FORMULA: C3H9Cl2NO
MOLECULAR WEIGHT: 146.01566
SMILES: C1C(O1)CCl.N.Cl

CAS RN: 93981-83-0
CAS Name: propanoic acid 11-methyldodecyl ester
OPENEYE Name: 11-methyldodecyl propanoate
IUPAC Name: 11-methyldodecyl propanoate
SYSTEMATIC NAME: 11-methyldodecyl propanoate
MOLECULAR FORMULA: C16H32O2
MOLECULAR WEIGHT: 256.42408
SMILES: CCC(=O)OCCCCCCCCCCC(C)C

CAS RN: 72175-30-5
CAS Name: N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine; hexanedioic acid dimethyl ester; pentanedioic acid dimethyl ester
OPENEYE Name: N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine; dimethyl hexanedioate; dimethyl pentanedioate
IUPAC Name: N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine; dimethyl hexanedioate; dimethyl pentanedioate
SYSTEMATIC NAME: N'-[2-[2-(2-azanylethylamino)ethylamino]ethyl]ethane-1,2-diamine; dimethyl hexanedioate; dimethyl pentanedioate
MOLECULAR FORMULA: C23H49N5O8
MOLECULAR WEIGHT: 523.66386
SMILES: COC(=O)CCCCC(=O)OC.COC(=O)CCCC(=O)OC.C(CNCCNCCNCCN)N

CAS RN: 114269-35-1
CAS Name: N-methylcarbamic acid (2-propan-2-yloxyphenyl) ester; phosphoric acid 2,2-dichloroethenyl dimethyl ester
OPENEYE Name: 2,2-dichlorovinyl dimethyl phosphate; (2-isopropoxyphenyl) N-methylcarbamate
IUPAC Name: 2,2-dichloroethenyl dimethyl phosphate; (2-propan-2-yloxyphenyl) N-methylcarbamate
SYSTEMATIC NAME: 2,2-bis(chloranyl)ethenyl dimethyl phosphate; (2-propan-2-yloxyphenyl) N-methylcarbamate
MOLECULAR FORMULA: C15H22Cl2NO7P
MOLECULAR WEIGHT: 430.217441
SMILES: CC(C)OC1=CC=CC=C1OC(=O)NC.COP(=O)(OC)OC=C(Cl)Cl

http://ChemLookup.com Compounds

CAS RN: 85030-62-2
CAS Name: 3-oxo-N-phenyl-2-[(2E)-2-(1,2,4-triazol-3-ylidene)hydrazinyl]butanamide
OPENEYE Name: 3-oxo-N-phenyl-2-[(2E)-2-(1,2,4-triazol-3-ylidene)hydrazino]butanamide
IUPAC Name: 3-oxo-N-phenyl-2-[(2E)-2-(1,2,4-triazol-3-ylidene)hydrazinyl]butanamide
SYSTEMATIC NAME: 3-oxidanylidene-N-phenyl-2-[(2E)-2-(1,2,4-triazol-3-ylidene)hydrazinyl]butanamide
MOLECULAR FORMULA: C12H12N6O2
MOLECULAR WEIGHT: 272.26268
SMILES: CC(=O)C(C(=O)NC1=CC=CC=C1)N/N=C/2\N=CN=N2

CAS RN: 94087-07-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H26O
MOLECULAR WEIGHT: 222.36634
SMILES: CC1(CCOC2C3CCCCC3C2(C1)C)C

CAS RN: 93964-66-0
CAS Name: disodium 2-anilino-5-[[4-(4-anilino-3-sulfonatoanilino)-2,5-dichloro-3,6-dioxo-1-cyclohexa-1,4-dienyl]amino]benzenesulfonate
OPENEYE Name: disodium 2-anilino-5-[[4-(4-anilino-3-sulfonato-anilino)-2,5-dichloro-3,6-dioxo-cyclohexa-1,4-dien-1-yl]amino]benzenesulfonate
IUPAC Name: disodium 2-anilino-5-[[4-(4-anilino-3-sulfonatoanilino)-2,5-dichloro-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]benzenesulfonate
SYSTEMATIC NAME: disodium 5-[[2,5-bis(chloranyl)-3,6-bis(oxidanylidene)-4-[(4-phenylazanyl-3-sulfonato-phenyl)amino]cyclohexa-1,4-dien-1-yl]amino]-2-phenylazanyl-benzenesulfonate
MOLECULAR FORMULA: C30H20Cl2N4Na2O8S2
MOLECULAR WEIGHT: 745.51734
SMILES: C1=CC=C(C=C1)NC2=C(C=C(C=C2)NC3=C(C(=O)C(=C(C3=O)Cl)NC4=CC(=C(C=C4)NC5=CC=CC=C5)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-].[Na+].[Na+]

CAS RN: 799247-52-2
CAS Name: N-[[2-chloro-5-[(1Z)-1-[(6-methyl-2-pyridinyl)methoxyimino]ethyl]phenyl]methyl]carbamic acid methyl ester
OPENEYE Name: methyl N-[[2-chloro-5-[(Z)-C-methyl-N-[(6-methyl-2-pyridyl)methoxy]carbonimidoyl]phenyl]methyl]carbamate
IUPAC Name: methyl N-[[2-chloro-5-[(Z)-C-methyl-N-[(6-methylpyridin-2-yl)methoxy]carbonimidoyl]phenyl]methyl]carbamate
SYSTEMATIC NAME: methyl N-[[2-chloranyl-5-[(Z)-C-methyl-N-[(6-methylpyridin-2-yl)methoxy]carbonimidoyl]phenyl]methyl]carbamate
MOLECULAR FORMULA: C18H20ClN3O3
MOLECULAR WEIGHT: 361.8227
SMILES: CC1=NC(=CC=C1)CO/N=C(/C)\C2=CC(=C(C=C2)Cl)CNC(=O)OC

CAS RN: 85554-73-0
CAS Name: 3-[3-[diethoxy(methyl)silyl]propoxy]-1-propanamine
OPENEYE Name: 3-[3-[diethoxy(methyl)silyl]propoxy]propan-1-amine
IUPAC Name: 3-[3-[diethoxy(methyl)silyl]propoxy]propan-1-amine
SYSTEMATIC NAME: 3-[3-[diethoxy(methyl)silyl]propoxy]propan-1-amine
MOLECULAR FORMULA: C11H27NO3Si
MOLECULAR WEIGHT: 249.42248
SMILES: CCO[Si](C)(CCCOCCCN)OCC

CAS RN: 93962-75-5
CAS Name: 2-bromopropanoic acid 2-[4-[2-[4-[2-(2-bromo-1-oxopropoxy)ethoxy]phenyl]propan-2-yl]phenoxy]ethyl ester
OPENEYE Name: 2-[4-[1-[4-[2-(2-bromopropanoyloxy)ethoxy]phenyl]-1-methyl-ethyl]phenoxy]ethyl 2-bromopropanoate
IUPAC Name: 2-[4-[2-[4-[2-(2-bromopropanoyloxy)ethoxy]phenyl]propan-2-yl]phenoxy]ethyl 2-bromopropanoate
SYSTEMATIC NAME: 2-[4-[2-[4-[2-(2-bromanylpropanoyloxy)ethoxy]phenyl]propan-2-yl]phenoxy]ethyl 2-bromanylpropanoate
MOLECULAR FORMULA: C25H30Br2O6
MOLECULAR WEIGHT: 586.3101
SMILES: CC(C(=O)OCCOC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCCOC(=O)C(C)Br)Br

CAS RN: 94094-67-4
CAS Name: 1-[3-(dimethylamino)propylamino]-4-(2-ethylhexylamino)anthracene-9,10-dione; 2-ethylhexanoic acid
OPENEYE Name: 1-[3-(dimethylamino)propylamino]-4-(2-ethylhexylamino)anthracene-9,10-dione; 2-ethylhexanoic acid
IUPAC Name: 1-[3-(dimethylamino)propylamino]-4-(2-ethylhexylamino)anthracene-9,10-dione; 2-ethylhexanoic acid
SYSTEMATIC NAME: 1-[3-(dimethylamino)propylamino]-4-(2-ethylhexylamino)anthracene-9,10-dione; 2-ethylhexanoic acid
MOLECULAR FORMULA: C35H53N3O4
MOLECULAR WEIGHT: 579.81302
SMILES: CCCCC(CC)CNC1=C2C(=C(C=C1)NCCCN(C)C)C(=O)C3=CC=CC=C3C2=O.CCCCC(CC)C(=O)O

CAS RN: 79255-89-3
CAS Name: potassium sodium 7-(4-amino-5-methoxy-2-methylphenyl)azonaphthalene-1,3-disulfonate
OPENEYE Name: potassium sodium 7-(4-amino-5-methoxy-2-methyl-phenyl)azonaphthalene-1,3-disulfonate
IUPAC Name: potassium sodium 7-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]naphthalene-1,3-disulfonate
SYSTEMATIC NAME: potassium sodium 7-[(4-azanyl-5-methoxy-2-methyl-phenyl)diazenyl]naphthalene-1,3-disulfonate
MOLECULAR FORMULA: C18H15KN3NaO7S2
MOLECULAR WEIGHT: 511.54567
SMILES: CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N.[Na+].[K+]

CAS RN: 97889-88-8
CAS Name: tetradecanoic acid [(3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-(1-oxotetradecoxy)ethyl]-3-oxolanyl] ester
OPENEYE Name: [(3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-tetradecanoyloxy-ethyl]tetrahydrofuran-3-yl] tetradecanoate
IUPAC Name: [(3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-tetradecanoyloxyethyl]oxolan-3-yl] tetradecanoate
SYSTEMATIC NAME: [(3R,4S)-4-oxidanyl-2-[(1R)-2-oxidanyl-1-tetradecanoyloxy-ethyl]oxolan-3-yl] tetradecanoate
MOLECULAR FORMULA: C34H64O7
MOLECULAR WEIGHT: 584.86776
SMILES: CCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](COC1[C@@H](CO)OC(=O)CCCCCCCCCCCCC)O

CAS RN: 94247-16-2
CAS Name: cadmium(2+); 2-[6-methylheptoxy(oxo)methyl]benzoate
OPENEYE Name: cadmium(2+); 2-(6-methylheptoxycarbonyl)benzoate
IUPAC Name: cadmium(2+); 2-(6-methylheptoxycarbonyl)benzoate
SYSTEMATIC NAME: cadmium(2+); 2-(6-methylheptoxycarbonyl)benzoate
MOLECULAR FORMULA: C32H42CdO8
MOLECULAR WEIGHT: 667.08208
SMILES: CC(C)CCCCCOC(=O)C1=CC=CC=C1C(=O)[O-].CC(C)CCCCCOC(=O)C1=CC=CC=C1C(=O)[O-].[Cd+2]

CAS RN: 82799-33-5
CAS Name: 1-[3-[3-[bis(2-hydroxyethyl)amino]propyl-(2-hydroxyethyl)amino]propyl-(2-hydroxyethyl)amino]-3-dodecoxy-2-propanol hydrochloride
OPENEYE Name: 1-[3-[3-[bis(2-hydroxyethyl)amino]propyl-(2-hydroxyethyl)amino]propyl-(2-hydroxyethyl)amino]-3-dodecoxy-propan-2-ol hydrochloride
IUPAC Name: 1-[3-[3-[bis(2-hydroxyethyl)amino]propyl-(2-hydroxyethyl)amino]propyl-(2-hydroxyethyl)amino]-3-dodecoxypropan-2-ol hydrochloride
SYSTEMATIC NAME: 1-[3-[3-[bis(2-hydroxyethyl)amino]propyl-(2-hydroxyethyl)amino]propyl-(2-hydroxyethyl)amino]-3-dodecoxy-propan-2-ol hydrochloride
MOLECULAR FORMULA: C29H64ClN3O6
MOLECULAR WEIGHT: 586.28796
SMILES: CCCCCCCCCCCCOCC(CN(CCCN(CCCN(CCO)CCO)CCO)CCO)O.Cl

CAS RN: 84625-57-0
CAS Name: acetic acid [1-formyl-7-(8-formyl-1,6,7-trihydroxy-3-methyl-5-propan-2-yl-2-naphthalenyl)-3,8-dihydroxy-6-methyl-4-propan-2-yl-2-naphthalenyl] ester
OPENEYE Name: [1-formyl-7-(8-formyl-1,6,7-trihydroxy-5-isopropyl-3-methyl-2-naphthyl)-3,8-dihydroxy-4-isopropyl-6-methyl-2-naphthyl] acetate
IUPAC Name: [1-formyl-7-(8-formyl-1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)-3,8-dihydroxy-6-methyl-4-propan-2-ylnaphthalen-2-yl] acetate
SYSTEMATIC NAME: [1-methanoyl-7-[8-methanoyl-3-methyl-1,6,7-tris(oxidanyl)-5-propan-2-yl-naphthalen-2-yl]-6-methyl-3,8-bis(oxidanyl)-4-propan-2-yl-naphthalen-2-yl] ethanoate
MOLECULAR FORMULA: C32H32O9
MOLECULAR WEIGHT: 560.59108
SMILES: CC1=C(C(=C2C(=C1)C(=C(C(=C2C=O)O)O)C(C)C)O)C3=C(C=C4C(=C3O)C(=C(C(=C4C(C)C)O)OC(=O)C)C=O)C

CAS RN: 74203-94-4
CAS Name: carbamimidoylimino-(phenylmethylene)ammonium; 2,3-dihydroxybutanedioate
OPENEYE Name: benzylidene(carbamimidoylimino)ammonium; 2,3-dihydroxybutanedioate
IUPAC Name: benzylidene(carbamimidoylimino)azanium; 2,3-dihydroxybutanedioate
SYSTEMATIC NAME: 2,3-bis(oxidanyl)butanedioate; carbamimidoylimino-(phenylmethylidene)azanium
MOLECULAR FORMULA: C20H22N8O6
MOLECULAR WEIGHT: 470.43868
SMILES: C1=CC=C(C=C1)C=[N+]=NC(=N)N.C1=CC=C(C=C1)C=[N+]=NC(=N)N.C(C(C(=O)[O-])O)(C(=O)[O-])O

CAS RN: 94113-43-6
CAS Name: acetic acid 3-(1,2,2-trimethylcyclohexyl)propyl ester
OPENEYE Name: 3-(1,2,2-trimethylcyclohexyl)propyl acetate
IUPAC Name: 3-(1,2,2-trimethylcyclohexyl)propyl acetate
SYSTEMATIC NAME: 3-(1,2,2-trimethylcyclohexyl)propyl ethanoate
MOLECULAR FORMULA: C14H26O2
MOLECULAR WEIGHT: 226.35504
SMILES: CC(=O)OCCCC1(CCCCC1(C)C)C

CAS RN: 156147-85-2
CAS Name: 2-methyl-2-propenoic acid 2-[[2,4,4,6,8,8-hexakis[2-(2-methyl-1-oxoprop-2-enoxy)ethoxy]-6-(2,4,6-tribromophenoxy)-1,3,5,7-tetraza-2$l^{5},4$l^{5},6$l^{5},8$l^{5}-tetraphosphacycloocta-1,3,5,7-tetraen-2-yl]oxy]ethyl ester
OPENEYE Name: 2-[[2,4,4,6,8,8-hexakis[2-(2-methylprop-2-enoyloxy)ethoxy]-6-(2,4,6-tribromophenoxy)-1,3,5,7-tetraza-2$l^{5},4$l^{5},6$l^{5},8$l^{5}-tetraphosphacycloocta-1,3,5,7-tetraen-2-yl]oxy]ethyl 2-methylprop-2-enoate
IUPAC Name: 2-[[2,4,4,6,8,8-hexakis[2-(2-methylprop-2-enoyloxy)ethoxy]-6-(2,4,6-tribromophenoxy)-1,3,5,7-tetraza-2$l^{5},4$l^{5},6$l^{5},8$l^{5}-tetraphosphacycloocta-1,3,5,7-tetraen-2-yl]oxy]ethyl 2-methylprop-2-enoate
SYSTEMATIC NAME: 2-[[2,4,4,6,8,8-hexakis[2-(2-methylprop-2-enoyloxy)ethoxy]-6-[2,4,6-tris(bromanyl)phenoxy]-1,3,5,7-tetraza-2$l^{5},4$l^{5},6$l^{5},8$l^{5}-tetraphosphacycloocta-1,3,5,7-tetraen-2-yl]oxy]ethyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C48H65Br3N4O22P4
MOLECULAR WEIGHT: 1413.650344
SMILES: CC(=C)C(=O)OCCOP1(=NP(=NP(=NP(=N1)(OCCOC(=O)C(=C)C)OCCOC(=O)C(=C)C)(OCCOC(=O)C(=C)C)OC2=C(C=C(C=C2Br)Br)Br)(OCCOC(=O)C(=C)C)OCCOC(=O)C(=C)C)OCCOC(=O)C(=C)C

CAS RN: 94237-03-3
CAS Name: 1-amino-2-propanol; nonanedioic acid
OPENEYE Name: 1-aminopropan-2-ol; nonanedioic acid
IUPAC Name: 1-aminopropan-2-ol; nonanedioic acid
SYSTEMATIC NAME: 1-azanylpropan-2-ol; nonanedioic acid
MOLECULAR FORMULA: C12H25NO5
MOLECULAR WEIGHT: 263.3306
SMILES: CC(CN)O.C(CCCC(=O)O)CCCC(=O)O

CAS RN: 93918-84-4
CAS Name: dodecyl-ethyl-[3-(2-ethylhexoxy)-3-oxopropyl]sulfonium; 4-methylbenzenesulfonate
OPENEYE Name: dodecyl-ethyl-[3-(2-ethylhexoxy)-3-oxo-propyl]sulfonium; 4-methylbenzenesulfonate
IUPAC Name: dodecyl-ethyl-[3-(2-ethylhexoxy)-3-oxopropyl]sulfanium; 4-methylbenzenesulfonate
SYSTEMATIC NAME: dodecyl-ethyl-[3-(2-ethylhexoxy)-3-oxidanylidene-propyl]sulfanium; 4-methylbenzenesulfonate
MOLECULAR FORMULA: C32H58O5S2
MOLECULAR WEIGHT: 586.92992
SMILES: CCCCCCCCCCCC[S+](CC)CCC(=O)OCC(CC)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]

CAS RN: 85223-02-5
CAS Name: 5-chloro-2-methylbenzenediazonium; naphthalene-1,5-disulfonate
OPENEYE Name: 5-chloro-2-methyl-benzenediazonium; naphthalene-1,5-disulfonate
IUPAC Name: 5-chloro-2-methylbenzenediazonium; naphthalene-1,5-disulfonate
SYSTEMATIC NAME: 5-chloranyl-2-methyl-benzenediazonium; naphthalene-1,5-disulfonate
MOLECULAR FORMULA: C24H18Cl2N4O6S2
MOLECULAR WEIGHT: 593.45892
SMILES: CC1=C(C=C(C=C1)Cl)[N+]#N.CC1=C(C=C(C=C1)Cl)[N+]#N.C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-]

CAS RN: 94159-42-9
CAS Name: 2-(1-hydroxy-2-methylpropan-2-yl)-1,3-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5,8-dione
OPENEYE Name: 2-(2-hydroxy-1,1-dimethyl-ethyl)-1,3-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5,8-dione
IUPAC Name: 2-(1-hydroxy-2-methylpropan-2-yl)-1,3-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5,8-dione
SYSTEMATIC NAME: 2-(2-methyl-1-oxidanyl-propan-2-yl)-1,3-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5,8-dione
MOLECULAR FORMULA: C10H15N3O3
MOLECULAR WEIGHT: 225.2444
SMILES: CC(C)(CO)N1CN2C(=O)C=CC(=O)N2C1

CAS RN: 145417-44-3
CAS Name: 7-oxabicyclo[4.1.0]heptane-4-carboxylic acid 7-oxabicyclo[4.1.0]heptan-4-ylmethyl ester; 2-propenenitrile; styrene
OPENEYE Name: 7-oxabicyclo[4.1.0]heptan-4-ylmethyl 7-oxabicyclo[4.1.0]heptane-4-carboxylate; prop-2-enenitrile; styrene
IUPAC Name: 7-oxabicyclo[4.1.0]heptan-4-ylmethyl 7-oxabicyclo[4.1.0]heptane-4-carboxylate; prop-2-enenitrile; styrene
SYSTEMATIC NAME: ethenylbenzene; 7-oxabicyclo[4.1.0]heptan-4-ylmethyl 7-oxabicyclo[4.1.0]heptane-4-carboxylate; prop-2-enenitrile
MOLECULAR FORMULA: C25H31NO4
MOLECULAR WEIGHT: 409.51794
SMILES: C=CC#N.C=CC1=CC=CC=C1.C1CC2C(O2)CC1COC(=O)C3CCC4C(C3)O4

CAS RN: 94199-82-3
CAS Name: trisodium hydroxy-[[phosphonatomethyl(propan-2-yl)amino]methyl]phosphinate
OPENEYE Name: trisodium hydroxy-[[isopropyl(phosphonatomethyl)amino]methyl]phosphinate
IUPAC Name: trisodium hydroxy-[[phosphonatomethyl(propan-2-yl)amino]methyl]phosphinate
SYSTEMATIC NAME: trisodium oxidanyl-[[phosphonatomethyl(propan-2-yl)amino]methyl]phosphinate
MOLECULAR FORMULA: C5H12NNa3O6P2
MOLECULAR WEIGHT: 313.068712
SMILES: CC(C)N(CP(=O)(O)[O-])CP(=O)([O-])[O-].[Na+].[Na+].[Na+]

CAS RN: 94094-43-6
CAS Name: 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoic acid 5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-1-oxopropoxy]pentyl ester; 2-hydroxypropane-1,2,3-tricarboxylic acid
OPENEYE Name: citric acid; 5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoate
IUPAC Name: 5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoate; 2-hydroxypropane-1,2,3-tricarboxylic acid
SYSTEMATIC NAME: 5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoate; 2-oxidanylpropane-1,2,3-tricarboxylic acid
MOLECULAR FORMULA: C63H82N2O26
MOLECULAR WEIGHT: 1283.32298
SMILES: COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2CCC(=O)OCCCCCOC(=O)CCN4CCC5=CC(=C(C=C5C4CC6=CC(=C(C=C6)OC)OC)OC)OC)OC)OC)OC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

CAS RN: 68921-87-9
CAS Name: N'-(2-aminoethyl)ethane-1,2-diamine; furan-2,5-dione; 3-(3-hydroxypropoxy)-1-propanol
OPENEYE Name: N'-(2-aminoethyl)ethane-1,2-diamine; furan-2,5-dione; 3-(3-hydroxypropoxy)propan-1-ol
IUPAC Name: N'-(2-aminoethyl)ethane-1,2-diamine; furan-2,5-dione; 3-(3-hydroxypropoxy)propan-1-ol
SYSTEMATIC NAME: N'-(2-azanylethyl)ethane-1,2-diamine; furan-2,5-dione; 3-(3-oxidanylpropoxy)propan-1-ol
MOLECULAR FORMULA: C14H29N3O6
MOLECULAR WEIGHT: 335.39656
SMILES: C1=CC(=O)OC1=O.C(CO)COCCCO.C(CNCCN)N

CAS RN: 83969-13-5
CAS Name: 5-[4-(dimethylamino)phenyl]azo-4-methyl-N,N-di(propan-2-yl)-1,3,4-thiadiazol-4-ium-2-amine; hydrogen sulfate
OPENEYE Name: 5-[4-(dimethylamino)phenyl]azo-N,N-diisopropyl-4-methyl-1,3,4-thiadiazol-4-ium-2-amine; hydrogen sulfate
IUPAC Name: 5-[[4-(dimethylamino)phenyl]diazenyl]-4-methyl-N,N-di(propan-2-yl)-1,3,4-thiadiazol-4-ium-2-amine; hydrogen sulfate
SYSTEMATIC NAME: 5-[[4-(dimethylamino)phenyl]diazenyl]-4-methyl-N,N-di(propan-2-yl)-1,3,4-thiadiazol-4-ium-2-amine; hydrogen sulfate
MOLECULAR FORMULA: C17H28N6O4S2
MOLECULAR WEIGHT: 444.57202
SMILES: CC(C)N(C1=N[N+](=C(S1)N=NC2=CC=C(C=C2)N(C)C)C)C(C)C.OS(=O)(=O)[O-]

CAS RN: 126948-55-8
CAS Name: 1-(3,3-diethoxy-2-methylpropyl)-4-methylbenzene
OPENEYE Name: 1-(3,3-diethoxy-2-methyl-propyl)-4-methyl-benzene
IUPAC Name: 1-(3,3-diethoxy-2-methylpropyl)-4-methylbenzene
SYSTEMATIC NAME: 1-(3,3-diethoxy-2-methyl-propyl)-4-methyl-benzene
MOLECULAR FORMULA: C15H24O2
MOLECULAR WEIGHT: 236.34986
SMILES: CCOC(C(C)CC1=CC=C(C=C1)C)OCC

CAS RN: 847780-86-3
CAS Name: 6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]-2-propanol
OPENEYE Name: 6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 1-[4-(2-isopropoxyethoxymethyl)phenoxy]-3-(isopropylamino)propan-2-ol
IUPAC Name: 6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]propan-2-ol
SYSTEMATIC NAME: 6-chloranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]propan-2-ol
MOLECULAR FORMULA: C25H39ClN4O8S2
MOLECULAR WEIGHT: 623.18216
SMILES: CC(C)NCC(COC1=CC=C(C=C1)COCCOC(C)C)O.C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl

CAS RN: 94200-63-2
CAS Name: tetraammonium [4-morpholinyl(phosphonato)methyl]-dioxido-oxophosphorane
OPENEYE Name: tetraammonium [morpholino(phosphonato)methyl]-dioxido-oxo-$l^{5}-phosphane
IUPAC Name: tetraazanium [morpholin-4-yl(phosphonato)methyl]-dioxido-oxo-$l^{5}-phosphane
SYSTEMATIC NAME: tetraazanium [morpholin-4-yl(phosphonato)methyl]-bis(oxidanidyl)-oxidanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C5H25N5O7P2
MOLECULAR WEIGHT: 329.228822
SMILES: C1COCCN1C(P(=O)([O-])[O-])P(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[NH4+]

CAS RN: 93982-18-4
CAS Name: 5-(2-nonylphenoxy)-5-oxopentanoic acid
OPENEYE Name: 5-(2-nonylphenoxy)-5-oxo-pentanoic acid
IUPAC Name: 5-(2-nonylphenoxy)-5-oxopentanoic acid
SYSTEMATIC NAME: 5-(2-nonylphenoxy)-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C20H30O4
MOLECULAR WEIGHT: 334.4498
SMILES: CCCCCCCCCC1=CC=CC=C1OC(=O)CCCC(=O)O

CAS RN: 17430-82-9
CAS Name: 1-dodecanamine; (Z)-9-octadecenoic acid
OPENEYE Name: dodecan-1-amine; (Z)-octadec-9-enoic acid
IUPAC Name: dodecan-1-amine; (Z)-octadec-9-enoic acid
SYSTEMATIC NAME: dodecan-1-amine; (Z)-octadec-9-enoic acid
MOLECULAR FORMULA: C30H61NO2
MOLECULAR WEIGHT: 467.81084
SMILES: CCCCCCCCCCCCN.CCCCCCCC/C=C\CCCCCCCC(=O)O

CAS RN: 71550-26-0
CAS Name: hexasodium (2S)-2-[bis(phosphonatomethyl)amino]butanedioate
OPENEYE Name: hexasodium (2S)-2-[bis(phosphonatomethyl)amino]butanedioate
IUPAC Name: hexasodium (2S)-2-[bis(phosphonatomethyl)amino]butanedioate
SYSTEMATIC NAME: hexasodium (2S)-2-[bis(phosphonatomethyl)amino]butanedioate
MOLECULAR FORMULA: C6H7NNa6O10P2
MOLECULAR WEIGHT: 453.006622
SMILES: C([C@@H](C(=O)[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

CAS RN: 93840-28-9
CAS Name: (5,5-dimethyl-2,3,4,4a,6,7-hexahydro-1H-naphthalen-1-yl)methanol
OPENEYE Name: (5,5-dimethyl-2,3,4,4a,6,7-hexahydro-1H-naphthalen-1-yl)methanol
IUPAC Name: (5,5-dimethyl-2,3,4,4a,6,7-hexahydro-1H-naphthalen-1-yl)methanol
SYSTEMATIC NAME: (5,5-dimethyl-2,3,4,4a,6,7-hexahydro-1H-naphthalen-1-yl)methanol
MOLECULAR FORMULA: C13H22O
MOLECULAR WEIGHT: 194.31318
SMILES: CC1(CCC=C2C1CCCC2CO)C

CAS RN: 94231-98-8
CAS Name: dihydrogen phosphate; 2-methyl-4,5-dihydro-1H-imidazol-3-ium
OPENEYE Name: dihydrogen phosphate; 2-methyl-4,5-dihydro-1H-imidazol-3-ium
IUPAC Name: dihydrogen phosphate; 2-methyl-4,5-dihydro-1H-imidazol-3-ium
SYSTEMATIC NAME: dihydrogen phosphate; 2-methyl-4,5-dihydro-1H-imidazol-3-ium
MOLECULAR FORMULA: C4H11N2O4P
MOLECULAR WEIGHT: 182.114901
SMILES: CC1=[NH+]CCN1.OP(=O)(O)[O-]

CAS RN: 93982-83-3
CAS Name: ammonium hydroxy-[[7-methyloctyl(phosphonomethyl)amino]methyl]phosphinate
OPENEYE Name: ammonium hydroxy-[[7-methyloctyl(phosphonomethyl)amino]methyl]phosphinate
IUPAC Name: azanium hydroxy-[[7-methyloctyl(phosphonomethyl)amino]methyl]phosphinate
SYSTEMATIC NAME: azanium [7-methyloctyl(phosphonomethyl)amino]methyl-oxidanyl-phosphinate
MOLECULAR FORMULA: C11H30N2O6P2
MOLECULAR WEIGHT: 348.313222
SMILES: CC(C)CCCCCCN(CP(=O)(O)O)CP(=O)(O)[O-].[NH4+]

CAS RN: 85068-69-5
CAS Name: 1-dodecanamine; 2-ethylhexanoic acid
OPENEYE Name: dodecan-1-amine; 2-ethylhexanoic acid
IUPAC Name: dodecan-1-amine; 2-ethylhexanoic acid
SYSTEMATIC NAME: dodecan-1-amine; 2-ethylhexanoic acid
MOLECULAR FORMULA: C20H43NO2
MOLECULAR WEIGHT: 329.56092
SMILES: CCCCCCCCCCCCN.CCCCC(CC)C(=O)O

CAS RN: 111173-25-2
CAS Name: 1,1,2,2-tetrafluoroethene; 1,1,2,2-tetrafluoro-2-(1,2,2-trifluoroethenoxy)ethanesulfonic acid
OPENEYE Name: 1,1,2,2-tetrafluoroethylene; 1,1,2,2-tetrafluoro-2-(1,2,2-trifluorovinyloxy)ethanesulfonic acid
IUPAC Name: 1,1,2,2-tetrafluoroethene; 1,1,2,2-tetrafluoro-2-(1,2,2-trifluoroethenoxy)ethanesulfonic acid
SYSTEMATIC NAME: 1,1,2,2-tetrakis(fluoranyl)ethene; 1,1,2,2-tetrakis(fluoranyl)-2-[1,2,2-tris(fluoranyl)ethenoxy]ethanesulfonic acid
MOLECULAR FORMULA: C6HF11O4S
MOLECULAR WEIGHT: 378.117175
SMILES: C(=C(F)F)(OC(C(F)(F)S(=O)(=O)O)(F)F)F.C(=C(F)F)(F)F

CAS RN: 94442-13-4
CAS Name: ethanamine; 2-(6-methoxy-2-naphthalenyl)propanoic acid
OPENEYE Name: ethanamine; 2-(6-methoxy-2-naphthyl)propanoic acid
IUPAC Name: ethanamine; 2-(6-methoxynaphthalen-2-yl)propanoic acid
SYSTEMATIC NAME: ethanamine; 2-(6-methoxynaphthalen-2-yl)propanoic acid
MOLECULAR FORMULA: C16H21NO3
MOLECULAR WEIGHT: 275.34284
SMILES: CCN.CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O

CAS RN: 94158-32-4
CAS Name: sodium 3-[(2E)-5,6-dichloro-2-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-3-methyl-1-benzimidazolyl]-1-propanesulfonate
OPENEYE Name: sodium 3-[(2E)-5,6-dichloro-2-(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)-3-methyl-benzimidazol-1-yl]propane-1-sulfonate
IUPAC Name: sodium 3-[(2E)-5,6-dichloro-2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-3-methylbenzimidazol-1-yl]propane-1-sulfonate
SYSTEMATIC NAME: sodium 3-[(2E)-5,6-bis(chloranyl)-2-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-3-methyl-benzimidazol-1-yl]propane-1-sulfonate
MOLECULAR FORMULA: C16H16Cl2N3NaO4S3
MOLECULAR WEIGHT: 504.40671
SMILES: CCN1C(=O)/C(=C\2/N(C3=CC(=C(C=C3N2CCCS(=O)(=O)[O-])Cl)Cl)C)/SC1=S.[Na+]