CAS RN: 84100-34-5
CAS Name: potassium 2-[(5E)-5-[(2Z)-2-(1-ethyl-2-pyrrolidinylidene)ethylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethanesulfonate
OPENEYE Name: potassium 2-[(5E)-5-[(2Z)-2-(1-ethylpyrrolidin-2-ylidene)ethylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]ethanesulfonate
IUPAC Name: potassium 2-[(5E)-5-[(2Z)-2-(1-ethylpyrrolidin-2-ylidene)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate
SYSTEMATIC NAME: potassium 2-[(5E)-5-[(2Z)-2-(1-ethylpyrrolidin-2-ylidene)ethylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate
MOLECULAR FORMULA: C13H17KN2O4S3
MOLECULAR WEIGHT: 400.57838
SMILES: CCN\1CCC/C1=C/C=C/2\C(=O)N(C(=S)S2)CCS(=O)(=O)[O-].[K+]
CAS RN: 84930-07-4
CAS Name: 2-[[bis(2-hydroxyethyl)amino]-oxomethyl]benzoic acid; 2-(2-hydroxyethylamino)ethanol
OPENEYE Name: 2-[bis(2-hydroxyethyl)carbamoyl]benzoic acid; 2-(2-hydroxyethylamino)ethanol
IUPAC Name: 2-[bis(2-hydroxyethyl)carbamoyl]benzoic acid; 2-(2-hydroxyethylamino)ethanol
SYSTEMATIC NAME: 2-[bis(2-hydroxyethyl)carbamoyl]benzoic acid; 2-(2-hydroxyethylamino)ethanol
MOLECULAR FORMULA: C16H26N2O7
MOLECULAR WEIGHT: 358.38684
SMILES: C1=CC=C(C(=C1)C(=O)N(CCO)CCO)C(=O)O.C(CO)NCCO
CAS RN: 94071-24-6
CAS Name: ethenyl-[ethenyl-bis(trimethylsilyloxy)silyl]oxy-bis(trimethylsilyloxy)silane
OPENEYE Name: [bis(trimethylsilyloxy)-vinyl-silyl]oxy-bis(trimethylsilyloxy)-vinyl-silane
IUPAC Name: ethenyl-[ethenyl-bis(trimethylsilyloxy)silyl]oxy-bis(trimethylsilyloxy)silane
SYSTEMATIC NAME: ethenyl-[ethenyl-bis(trimethylsilyloxy)silyl]oxy-bis(trimethylsilyloxy)silane
MOLECULAR FORMULA: C16H42O5Si6
MOLECULAR WEIGHT: 483.01468
SMILES: C[Si](C)(C)O[Si](C=C)(O[Si](C)(C)C)O[Si](C=C)(O[Si](C)(C)C)O[Si](C)(C)C
CAS RN: 24606-42-6
CAS Name: dipotassium zinc phosphonato phosphate
OPENEYE Name: dipotassium zinc phosphonato phosphate
IUPAC Name: dipotassium zinc phosphonato phosphate
SYSTEMATIC NAME: dipotassium zinc phosphonato phosphate
MOLECULAR FORMULA: K2O7P2Zn
MOLECULAR WEIGHT: 317.548922
SMILES: [O-]P(=O)([O-])OP(=O)([O-])[O-].[K+].[K+].[Zn+2]
CAS RN: 77847-15-5
CAS Name: sodium 4-benzamido-2-[[1-(2-chlorophenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzenesulfonate
OPENEYE Name: sodium 4-benzamido-2-[[1-(2-chlorophenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzenesulfonate
IUPAC Name: sodium 4-benzamido-2-[[1-(2-chlorophenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzenesulfonate
SYSTEMATIC NAME: sodium 4-benzamido-2-[[1-(2-chlorophenyl)-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]benzenesulfonate
MOLECULAR FORMULA: C23H17ClN5NaO5S
MOLECULAR WEIGHT: 533.91935
SMILES: CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3)S(=O)(=O)[O-])C4=CC=CC=C4Cl.[Na+]
CAS RN: 93964-37-5
CAS Name: 2-aminoethanol; [(E)-octadec-1-enyl] dihydrogen phosphate
OPENEYE Name: 2-aminoethanol; [(E)-octadec-1-enyl] dihydrogen phosphate
IUPAC Name: 2-aminoethanol; [(E)-octadec-1-enyl] dihydrogen phosphate
SYSTEMATIC NAME: 2-azanylethanol; [(E)-octadec-1-enyl] dihydrogen phosphate
MOLECULAR FORMULA: C20H44NO5P
MOLECULAR WEIGHT: 409.540821
SMILES: CCCCCCCCCCCCCCCC/C=C/OP(=O)(O)O.C(CO)N
CAS RN: 83950-25-8
CAS Name: dihydrogen phosphate; 9-ethyl-3-[(E)-2-(1,3,3-trimethyl-2-indol-1-iumyl)ethenyl]carbazole
OPENEYE Name: dihydrogen phosphate; 9-ethyl-3-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)vinyl]carbazole
IUPAC Name: dihydrogen phosphate; 9-ethyl-3-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]carbazole
SYSTEMATIC NAME: dihydrogen phosphate; 9-ethyl-3-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]carbazole
MOLECULAR FORMULA: C27H29N2O4P
MOLECULAR WEIGHT: 476.503921
SMILES: CCN1C2=C(C=C(C=C2)/C=C/C3=[N+](C4=CC=CC=C4C3(C)C)C)C5=CC=CC=C51.OP(=O)(O)[O-]
CAS RN: 93840-26-7
CAS Name: (8,8-dimethyl-2,3,4,4a,5,6,7,8a-octahydro-1H-naphthalen-1-yl)methanol
OPENEYE Name: (8,8-dimethyldecalin-1-yl)methanol
IUPAC Name: (8,8-dimethyl-2,3,4,4a,5,6,7,8a-octahydro-1H-naphthalen-1-yl)methanol
SYSTEMATIC NAME: (8,8-dimethyl-2,3,4,4a,5,6,7,8a-octahydro-1H-naphthalen-1-yl)methanol
MOLECULAR FORMULA: C13H24O
MOLECULAR WEIGHT: 196.32906
SMILES: CC1(CCCC2C1C(CCC2)CO)C
CAS RN: 93894-67-8
CAS Name: lithium 1,1,2,2,3,3,4,4,5,5,6,7,7,7-tetradecafluoro-6-(trifluoromethyl)-1-heptanesulfonate
OPENEYE Name: lithium 1,1,2,2,3,3,4,4,5,5,6,7,7,7-tetradecafluoro-6-(trifluoromethyl)heptane-1-sulfonate
IUPAC Name: lithium 1,1,2,2,3,3,4,4,5,5,6,7,7,7-tetradecafluoro-6-(trifluoromethyl)heptane-1-sulfonate
SYSTEMATIC NAME: lithium 1,1,2,2,3,3,4,4,5,5,6,7,7,7-tetradecakis(fluoranyl)-6-(trifluoromethyl)heptane-1-sulfonate
MOLECULAR FORMULA: C8F17LiO3S
MOLECULAR WEIGHT: 506.062654
SMILES: [Li+].C(C(C(C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)(C(F)(F)F)F
CAS RN: 72894-26-9
CAS Name: trisodium (3Z)-5-[(5-chloro-6-methyl-2-methylsulfonyl-4-pyrimidinyl)amino]-4-oxo-3-[(1-sulfonato-2-naphthalenyl)hydrazinylidene]naphthalene-2,7-disulfonate
OPENEYE Name: trisodium (3Z)-5-[(5-chloro-6-methyl-2-methylsulfonyl-pyrimidin-4-yl)amino]-4-oxo-3-[(1-sulfonato-2-naphthyl)hydrazono]naphthalene-2,7-disulfonate
IUPAC Name: trisodium (3Z)-5-[(5-chloro-6-methyl-2-methylsulfonylpyrimidin-4-yl)amino]-4-oxo-3-[(1-sulfonatonaphthalen-2-yl)hydrazinylidene]naphthalene-2,7-disulfonate
SYSTEMATIC NAME: trisodium (3Z)-5-[(5-chloranyl-6-methyl-2-methylsulfonyl-pyrimidin-4-yl)amino]-4-oxidanylidene-3-[(1-sulfonatonaphthalen-2-yl)hydrazinylidene]naphthalene-2,7-disulfonate
MOLECULAR FORMULA: C26H17ClN5Na3O12S4
MOLECULAR WEIGHT: 824.12179
SMILES: CC1=C(C(=NC(=N1)S(=O)(=O)C)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N\NC4=C(C5=CC=CC=C5C=C4)S(=O)(=O)[O-])/C3=O)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]
CAS RN: 94022-76-1
CAS Name: N-[2-(2-dodecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]tetradecanamide; methyl sulfate
OPENEYE Name: N-[2-(2-dodecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]tetradecanamide; methyl sulfate
IUPAC Name: N-[2-(2-dodecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]tetradecanamide; methyl sulfate
SYSTEMATIC NAME: N-[2-(2-dodecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]tetradecanamide; methyl sulfate
MOLECULAR FORMULA: C33H67N3O5S
MOLECULAR WEIGHT: 617.96718
SMILES: CCCCCCCCCCCCCC(=O)NCC[N+]1(CCN=C1CCCCCCCCCCCC)C.COS(=O)(=O)[O-]
CAS RN: 20120-48-3
CAS Name: disodium 4-hydroxy-6-[(8-hydroxy-6-sulfonato-2-naphthalenyl)amino]-2-naphthalenesulfonate
OPENEYE Name: disodium 4-hydroxy-6-[(8-hydroxy-6-sulfonato-2-naphthyl)amino]naphthalene-2-sulfonate
IUPAC Name: disodium 4-hydroxy-6-[(8-hydroxy-6-sulfonatonaphthalen-2-yl)amino]naphthalene-2-sulfonate
SYSTEMATIC NAME: disodium 4-oxidanyl-6-[(8-oxidanyl-6-sulfonato-naphthalen-2-yl)amino]naphthalene-2-sulfonate
MOLECULAR FORMULA: C20H13NNa2O8S2
MOLECULAR WEIGHT: 505.42866
SMILES: C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)[O-])O)NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])O.[Na+].[Na+]
CAS RN: 82657-85-0
CAS Name: [amino(chloro)methylidene]ammonium sulfate
OPENEYE Name: [amino(chloro)methylene]ammonium sulfate
IUPAC Name: [amino(chloro)methylidene]azanium sulfate
SYSTEMATIC NAME: [azanyl(chloranyl)methylidene]azanium sulfate
MOLECULAR FORMULA: C2H8Cl2N4O4S
MOLECULAR WEIGHT: 255.08032
SMILES: C(=[NH2+])(N)Cl.C(=[NH2+])(N)Cl.[O-]S(=O)(=O)[O-]
CAS RN: 105658-30-8
CAS Name: 2-aminoethanol; N-hydroxy-N-phenylnitrous amide
OPENEYE Name: 2-aminoethanol; N-hydroxy-N-phenyl-nitrous amide
IUPAC Name: 2-aminoethanol; N-hydroxy-N-phenylnitrous amide
SYSTEMATIC NAME: 2-azanylethanol; N-oxidanyl-N-phenyl-nitrous amide
MOLECULAR FORMULA: C8H13N3O3
MOLECULAR WEIGHT: 199.20712
SMILES: C1=CC=C(C=C1)N(N=O)O.C(CO)N
CAS RN: 94107-66-1
CAS Name: diammonium [phosphonatomethyl(propan-2-yl)amino]methylphosphonic acid
OPENEYE Name: diammonium [isopropyl(phosphonatomethyl)amino]methylphosphonic acid
IUPAC Name: diazanium [phosphonatomethyl(propan-2-yl)amino]methylphosphonic acid
SYSTEMATIC NAME: diazanium [phosphonatomethyl(propan-2-yl)amino]methylphosphonic acid
MOLECULAR FORMULA: C5H21N3O6P2
MOLECULAR WEIGHT: 281.184262
SMILES: CC(C)N(CP(=O)(O)O)CP(=O)([O-])[O-].[NH4+].[NH4+]
CAS RN: 85005-56-7
CAS Name: 2-[2-(6-methylheptyl)phenoxy]ethanol
OPENEYE Name: 2-[2-(6-methylheptyl)phenoxy]ethanol
IUPAC Name: 2-[2-(6-methylheptyl)phenoxy]ethanol
SYSTEMATIC NAME: 2-[2-(6-methylheptyl)phenoxy]ethanol
MOLECULAR FORMULA: C16H26O2
MOLECULAR WEIGHT: 250.37644
SMILES: CC(C)CCCCCC1=CC=CC=C1OCCO
CAS RN: 99670-33-4
CAS Name: N-[2-[2-[2-[2-[bis(2-methylprop-2-enyl)amino]ethyl-(2-methylprop-2-enyl)amino]ethyl-(2-methylprop-2-enyl)amino]ethyl-(2-methylprop-2-enyl)amino]ethyl]octanamide
OPENEYE Name: N-[2-[2-[2-[2-[bis(2-methylallyl)amino]ethyl-(2-methylallyl)amino]ethyl-(2-methylallyl)amino]ethyl-(2-methylallyl)amino]ethyl]octanamide
IUPAC Name: N-[2-[2-[2-[2-[bis(2-methylprop-2-enyl)amino]ethyl-(2-methylprop-2-enyl)amino]ethyl-(2-methylprop-2-enyl)amino]ethyl-(2-methylprop-2-enyl)amino]ethyl]octanamide
SYSTEMATIC NAME: N-[2-[2-[2-[2-[bis(2-methylprop-2-enyl)amino]ethyl-(2-methylprop-2-enyl)amino]ethyl-(2-methylprop-2-enyl)amino]ethyl-(2-methylprop-2-enyl)amino]ethyl]octanamide
MOLECULAR FORMULA: C36H67N5O
MOLECULAR WEIGHT: 585.95008
SMILES: CCCCCCCC(=O)NCCN(CCN(CCN(CCN(CC(=C)C)CC(=C)C)CC(=C)C)CC(=C)C)CC(=C)C
CAS RN: 72102-83-1
CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 4-[5-methoxy-4-[[[2-methoxy-5-methyl-4-(4-sulfophenyl)azoanilino]-oxomethyl]amino]-2-methylphenyl]azobenzenesulfonic acid
OPENEYE Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 4-[5-methoxy-4-[[2-methoxy-5-methyl-4-(4-sulfophenyl)azo-phenyl]carbamoylamino]-2-methyl-phenyl]azobenzenesulfonic acid
IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 4-[[5-methoxy-4-[[2-methoxy-5-methyl-4-[(4-sulfophenyl)diazenyl]phenyl]carbamoylamino]-2-methylphenyl]diazenyl]benzenesulfonic acid
SYSTEMATIC NAME: 2-[bis(2-hydroxyethyl)amino]ethanol; 4-[[5-methoxy-4-[[2-methoxy-5-methyl-4-[(4-sulfophenyl)diazenyl]phenyl]carbamoylamino]-2-methyl-phenyl]diazenyl]benzenesulfonic acid
MOLECULAR FORMULA: C41H58N8O15S2
MOLECULAR WEIGHT: 967.07382
SMILES: CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)OC)NC(=O)NC3=C(C=C(C(=C3)C)N=NC4=CC=C(C=C4)S(=O)(=O)O)OC.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO
CAS RN: 151911-63-6
CAS Name: 1-butanamine; 2,3-di(propan-2-yl)-1-naphthalenesulfonic acid
OPENEYE Name: butan-1-amine; 2,3-diisopropylnaphthalene-1-sulfonic acid
IUPAC Name: butan-1-amine; 2,3-di(propan-2-yl)naphthalene-1-sulfonic acid
SYSTEMATIC NAME: butan-1-amine; 2,3-di(propan-2-yl)naphthalene-1-sulfonic acid
MOLECULAR FORMULA: C20H31NO3S
MOLECULAR WEIGHT: 365.53004
SMILES: CCCCN.CC(C)C1=CC2=CC=CC=C2C(=C1C(C)C)S(=O)(=O)O
CAS RN: 93892-22-9
CAS Name: sodium 4-[[(3Z)-3-[(E)-(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)hydrazinylidene]-6-hydroxy-4-oxo-1-cyclohexa-1,5-dienyl]hydrazo]-1-naphthalenesulfonate
OPENEYE Name: sodium 4-[2-[(3Z)-3-[(E)-(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)hydrazono]-6-hydroxy-4-oxo-cyclohexa-1,5-dien-1-yl]hydrazino]naphthalene-1-sulfonate
IUPAC Name: sodium 4-[2-[(3Z)-3-[(E)-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinylidene]-6-hydroxy-4-oxocyclohexa-1,5-dien-1-yl]hydrazinyl]naphthalene-1-sulfonate
SYSTEMATIC NAME: sodium 4-[2-[(3Z)-3-[(E)-(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinylidene]-6-oxidanyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]hydrazinyl]naphthalene-1-sulfonate
MOLECULAR FORMULA: C22H14ClN4NaO6S
MOLECULAR WEIGHT: 520.87753
SMILES: C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])NNC3=C/C(=N/N=C/4\C=C(C=CC4=O)Cl)/C(=O)C=C3O.[Na+]
CAS RN: 93777-40-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H22O
MOLECULAR WEIGHT: 206.32388
SMILES: CC1CCC2(O1)CC3CC2C4C3CCC4
CAS RN: 95046-25-6
CAS Name: sodium 3-[(2Z)-2-[(2Z)-2-[3-(2-hydroxyethyl)-5-oxo-1-phenyl-2-sulfanylidene-4-imidazolidinylidene]ethylidene]-1,3-benzoxazol-3-yl]propyl sulfate
OPENEYE Name: sodium 3-[(2Z)-2-[(2Z)-2-[3-(2-hydroxyethyl)-5-oxo-1-phenyl-2-thioxo-imidazolidin-4-ylidene]ethylidene]-1,3-benzoxazol-3-yl]propyl sulfate
IUPAC Name: sodium 3-[(2Z)-2-[(2Z)-2-[3-(2-hydroxyethyl)-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-ylidene]ethylidene]-1,3-benzoxazol-3-yl]propyl sulfate
SYSTEMATIC NAME: sodium 3-[(2Z)-2-[(2Z)-2-[3-(2-hydroxyethyl)-5-oxidanylidene-1-phenyl-2-sulfanylidene-imidazolidin-4-ylidene]ethylidene]-1,3-benzoxazol-3-yl]propyl sulfate
MOLECULAR FORMULA: C23H22N3NaO7S2
MOLECULAR WEIGHT: 539.55645
SMILES: C1=CC=C(C=C1)N2C(=O)/C(=C/C=C\3/N(C4=CC=CC=C4O3)CCCOS(=O)(=O)[O-])/N(C2=S)CCO.[Na+]
CAS RN: 71501-20-7
CAS Name: iodomethane; N,N,2-trimethyl-6-quinolinamine
OPENEYE Name: iodomethane; N,N,2-trimethylquinolin-6-amine
IUPAC Name: iodomethane; N,N,2-trimethylquinolin-6-amine
SYSTEMATIC NAME: iodanylmethane; N,N,2-trimethylquinolin-6-amine
MOLECULAR FORMULA: C13H17IN2
MOLECULAR WEIGHT: 328.19195
SMILES: CC1=NC2=C(C=C1)C=C(C=C2)N(C)C.CI
CAS RN: 94108-88-0
CAS Name: 2-(2-heptyl-4,5-dihydroimidazol-1-yl)ethanol hydrochloride
OPENEYE Name: 2-(2-heptyl-4,5-dihydroimidazol-1-yl)ethanol hydrochloride
IUPAC Name: 2-(2-heptyl-4,5-dihydroimidazol-1-yl)ethanol hydrochloride
SYSTEMATIC NAME: 2-(2-heptyl-4,5-dihydroimidazol-1-yl)ethanol hydrochloride
MOLECULAR FORMULA: C12H25ClN2O
MOLECULAR WEIGHT: 248.7927
SMILES: CCCCCCCC1=NCCN1CCO.Cl
CAS RN: 97403-99-1
CAS Name: diammonium disodium 5-[[4-chloro-6-(3-phosphonatoanilino)-1,3,5-triazin-2-yl]amino]-2-[[8-[ethyl-[(3-sulfonatophenyl)methyl]amino]-10-(4-methoxy-3-sulfonatophenyl)-2-phenazin-10-iumyl]amino]benzenesulfonate
OPENEYE Name: diammonium disodium 5-[[4-chloro-6-(3-phosphonatoanilino)-1,3,5-triazin-2-yl]amino]-2-[[8-[ethyl-[(3-sulfonatophenyl)methyl]amino]-10-(4-methoxy-3-sulfonato-phenyl)phenazin-10-ium-2-yl]amino]benzenesulfonate
IUPAC Name: diazanium disodium 5-[[4-chloro-6-(3-phosphonatoanilino)-1,3,5-triazin-2-yl]amino]-2-[[8-[ethyl-[(3-sulfonatophenyl)methyl]amino]-10-(4-methoxy-3-sulfonatophenyl)phenazin-10-ium-2-yl]amino]benzenesulfonate
SYSTEMATIC NAME: diazanium disodium 5-[[4-chloranyl-6-[(3-phosphonatophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-[[8-[ethyl-[(3-sulfonatophenyl)methyl]amino]-10-(4-methoxy-3-sulfonato-phenyl)phenazin-10-ium-2-yl]amino]benzenesulfonate
MOLECULAR FORMULA: C43H41ClN11Na2O13PS3
MOLECULAR WEIGHT: 1128.452841
SMILES: CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC3=[N+](C4=C(C=CC(=C4)NC5=C(C=C(C=C5)NC6=NC(=NC(=N6)NC7=CC(=CC=C7)P(=O)([O-])[O-])Cl)S(=O)(=O)[O-])N=C3C=C2)C8=CC(=C(C=C8)OC)S(=O)(=O)[O-].[NH4+].[NH4+].[Na+].[Na+]
CAS RN: 93925-08-7
CAS Name: 2,2-dimethylpropane-1,3-diol; hexanedioic acid; hexane-1,6-diol; [4-(hydroxymethyl)cyclohexyl]methanol
OPENEYE Name: adipic acid; 2,2-dimethylpropane-1,3-diol; hexane-1,6-diol; [4-(hydroxymethyl)cyclohexyl]methanol
IUPAC Name: 2,2-dimethylpropane-1,3-diol; hexanedioic acid; hexane-1,6-diol; [4-(hydroxymethyl)cyclohexyl]methanol
SYSTEMATIC NAME: 2,2-dimethylpropane-1,3-diol; hexanedioic acid; hexane-1,6-diol; [4-(hydroxymethyl)cyclohexyl]methanol
MOLECULAR FORMULA: C25H52O10
MOLECULAR WEIGHT: 512.67438
SMILES: CC(C)(CO)CO.C1CC(CCC1CO)CO.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O
CAS RN: 13981-60-7
CAS Name: beryllium-8
OPENEYE Name: beryllium-8
IUPAC Name: beryllium-8
SYSTEMATIC NAME: beryllium-8
MOLECULAR FORMULA: Be
MOLECULAR WEIGHT: 8.005305
SMILES: [8Be]
CAS RN: 94291-91-5
CAS Name: 3-chloro-3-methyl-3a,4,5,6,7,7a-hexahydrobenzofuran-2-one
OPENEYE Name: 3-chloro-3-methyl-3a,4,5,6,7,7a-hexahydrobenzofuran-2-one
IUPAC Name: 3-chloro-3-methyl-3a,4,5,6,7,7a-hexahydro-1-benzofuran-2-one
SYSTEMATIC NAME: 3-chloranyl-3-methyl-3a,4,5,6,7,7a-hexahydro-1-benzofuran-2-one
MOLECULAR FORMULA: C9H13ClO2
MOLECULAR WEIGHT: 188.65132
SMILES: CC1(C2CCCCC2OC1=O)Cl
CAS RN: 70788-64-6
CAS Name: 2-methyl-2-propenoic acid butyl ester; N-(2-methylpropoxymethyl)-2-propenamide
OPENEYE Name: butyl 2-methylprop-2-enoate; N-(isobutoxymethyl)prop-2-enamide
IUPAC Name: butyl 2-methylprop-2-enoate; N-(2-methylpropoxymethyl)prop-2-enamide
SYSTEMATIC NAME: butyl 2-methylprop-2-enoate; N-(2-methylpropoxymethyl)prop-2-enamide
MOLECULAR FORMULA: C16H29NO4
MOLECULAR WEIGHT: 299.40576
SMILES: CCCCOC(=O)C(=C)C.CC(C)COCNC(=O)C=C
CAS RN: 93964-41-1
CAS Name: N-[4-[(9-ethyl-3-carbazolyl)-[4-[4-[(9-ethyl-3-carbazolyl)-[4-(4-methylanilino)phenyl]methyl]-N-methylanilino]phenyl]methyl]phenyl]-4-methylaniline
OPENEYE Name: N-[4-[(9-ethylcarbazol-3-yl)-[4-[4-[(9-ethylcarbazol-3-yl)-[4-(4-methylanilino)phenyl]methyl]-N-methyl-anilino]phenyl]methyl]phenyl]-4-methyl-aniline
IUPAC Name: N-[4-[(9-ethylcarbazol-3-yl)-[4-[4-[(9-ethylcarbazol-3-yl)-[4-(4-methylanilino)phenyl]methyl]-N-methylanilino]phenyl]methyl]phenyl]-4-methylaniline
SYSTEMATIC NAME: N-[4-[(9-ethylcarbazol-3-yl)-[4-[[4-[(9-ethylcarbazol-3-yl)-[4-[(4-methylphenyl)amino]phenyl]methyl]phenyl]-methyl-amino]phenyl]methyl]phenyl]-4-methyl-aniline
MOLECULAR FORMULA: C69H61N5
MOLECULAR WEIGHT: 960.25614
SMILES: CCN1C2=C(C=C(C=C2)C(C3=CC=C(C=C3)NC4=CC=C(C=C4)C)C5=CC=C(C=C5)N(C)C6=CC=C(C=C6)C(C7=CC=C(C=C7)NC8=CC=C(C=C8)C)C9=CC2=C(C=C9)N(C3=CC=CC=C32)CC)C2=CC=CC=C21
CAS RN: 69856-03-7
CAS Name: benzene-1,4-diol; 4-tert-butylphenol; formaldehyde
OPENEYE Name: benzene-1,4-diol; 4-tert-butylphenol; formaldehyde
IUPAC Name: benzene-1,4-diol; 4-tert-butylphenol; formaldehyde
SYSTEMATIC NAME: benzene-1,4-diol; 4-tert-butylphenol; methanal
MOLECULAR FORMULA: C17H22O4
MOLECULAR WEIGHT: 290.35418
SMILES: CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC(=CC=C1O)O
CAS RN: 90931-88-7
CAS Name: (2E)-2-[[6-(4-morpholinyl)-3-pyridazinyl]hydrazinylidene]-1-cyclooctanone
OPENEYE Name: (2E)-2-[(6-morpholinopyridazin-3-yl)hydrazono]cyclooctanone
IUPAC Name: (2E)-2-[(6-morpholin-4-ylpyridazin-3-yl)hydrazinylidene]cyclooctan-1-one
SYSTEMATIC NAME: (2E)-2-[(6-morpholin-4-ylpyridazin-3-yl)hydrazinylidene]cyclooctan-1-one
MOLECULAR FORMULA: C16H23N5O2
MOLECULAR WEIGHT: 317.38612
SMILES: C1CCCC(=O)/C(=N/NC2=NN=C(C=C2)N3CCOCC3)/CC1
CAS RN: 82339-07-9
CAS Name: benzoic acid (3-hydroxy-2,2-dimethylpropyl) ester; 2,2-bis(hydroxymethyl)propane-1,3-diol; isobenzofuran-1,3-dione
OPENEYE Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; (3-hydroxy-2,2-dimethyl-propyl) benzoate; isobenzofuran-1,3-dione
IUPAC Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; (3-hydroxy-2,2-dimethylpropyl) benzoate
SYSTEMATIC NAME: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; (2,2-dimethyl-3-oxidanyl-propyl) benzoate
MOLECULAR FORMULA: C25H32O10
MOLECULAR WEIGHT: 492.51558
SMILES: CC(C)(CO)COC(=O)C1=CC=CC=C1.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O
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