Friday, October 26, 2012

http://ChemLookup.com Compounds




CAS RN: 57363-13-0
CAS Name: sodium 5-ethyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylate
OPENEYE Name: sodium 5-ethyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylate
IUPAC Name: sodium 5-ethyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylate
SYSTEMATIC NAME: sodium 5-ethyl-8-oxidanylidene-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylate
MOLECULAR FORMULA: C14H12NNaO4
MOLECULAR WEIGHT: 281.23915
SMILES: CCN1C=C(C(=O)C2=CC3=C(CCO3)C=C21)C(=O)[O-].[Na+]
Structure:

CAS RN: 63667-16-3
CAS Name: N-[6-(cyclohexylthio)-1H-benzimidazol-2-yl]carbamic acid methyl ester
OPENEYE Name: methyl N-(6-cyclohexylsulfanyl-1H-benzimidazol-2-yl)carbamate
IUPAC Name: methyl N-(6-cyclohexylsulfanyl-1H-benzimidazol-2-yl)carbamate
SYSTEMATIC NAME: methyl N-(6-cyclohexylsulfanyl-1H-benzimidazol-2-yl)carbamate
MOLECULAR FORMULA: C15H19N3O2S
MOLECULAR WEIGHT: 305.39526
SMILES: COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3CCCCC3
Structure:

CAS RN: 53378-71-5
CAS Name: 2-(6-methoxy-6-methylheptan-2-yl)oxirane
OPENEYE Name: 2-(5-methoxy-1,5-dimethyl-hexyl)oxirane
IUPAC Name: 2-(6-methoxy-6-methylheptan-2-yl)oxirane
SYSTEMATIC NAME: 2-(6-methoxy-6-methyl-heptan-2-yl)oxirane
MOLECULAR FORMULA: C11H22O2
MOLECULAR WEIGHT: 186.29118
SMILES: CC(CCCC(C)(C)OC)C1CO1
Structure:

CAS RN: 73348-75-1
CAS Name: 4-[2,9-dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid
OPENEYE Name: 4-[2,9-dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid
IUPAC Name: 4-[2,9-dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid
SYSTEMATIC NAME: 4-[2,9-dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid
MOLECULAR FORMULA: C26H20N2O6S2
MOLECULAR WEIGHT: 520.5768
SMILES: CC1=NC2=C(C=CC3=C2N=C(C=C3C4=CC=C(C=C4)S(=O)(=O)O)C)C(=C1)C5=CC=C(C=C5)S(=O)(=O)O
Structure:

CAS RN: 40386-51-4
CAS Name: disodium 4-[2,9-dimethyl-7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate
OPENEYE Name: disodium 4-[2,9-dimethyl-7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate
IUPAC Name: disodium 4-[2,9-dimethyl-7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate
SYSTEMATIC NAME: disodium 4-[2,9-dimethyl-7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate
MOLECULAR FORMULA: C26H18N2Na2O6S2
MOLECULAR WEIGHT: 564.54046
SMILES: CC1=NC2=C(C=CC3=C2N=C(C=C3C4=CC=C(C=C4)S(=O)(=O)[O-])C)C(=C1)C5=CC=C(C=C5)S(=O)(=O)[O-].[Na+].[Na+]
Structure:

CAS RN: 109005-46-1
CAS Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
OPENEYE Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol
IUPAC Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C31H35ClN2O3
MOLECULAR WEIGHT: 519.0742
SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N
Structure:

CAS RN: 111439-79-3
CAS Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
OPENEYE Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol
IUPAC Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C31H35ClN2O3
MOLECULAR WEIGHT: 519.0742
SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N
Structure:

CAS RN: 120913-44-2
CAS Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
OPENEYE Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol
IUPAC Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C31H35ClN2O3
MOLECULAR WEIGHT: 519.0742
SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N
Structure:

CAS RN: 130319-97-0
CAS Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
OPENEYE Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol
IUPAC Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C31H35ClN2O3
MOLECULAR WEIGHT: 519.0742
SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N
Structure:

CAS RN: 136748-57-7
CAS Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
OPENEYE Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol
IUPAC Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C31H35ClN2O3
MOLECULAR WEIGHT: 519.0742
SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N
Structure:

CAS RN: 193695-69-1
CAS Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
OPENEYE Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol
IUPAC Name: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 4-[(4-aminophenyl)methyl]aniline; 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C31H35ClN2O3
MOLECULAR WEIGHT: 519.0742
SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N
Structure:

CAS RN: 53302-95-7
CAS Name: (4-aminophenyl)-(4-propan-2-ylphenyl)methanone
OPENEYE Name: (4-aminophenyl)-(4-isopropylphenyl)methanone
IUPAC Name: (4-aminophenyl)-(4-propan-2-ylphenyl)methanone
SYSTEMATIC NAME: (4-aminophenyl)-(4-propan-2-ylphenyl)methanone
MOLECULAR FORMULA: C16H17NO
MOLECULAR WEIGHT: 239.31228
SMILES: CC(C)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N
Structure:

CAS RN: 152818-00-3
CAS Name: 2,2-bis(4-hydroxyphenyl)acetic acid
OPENEYE Name: 2,2-bis(4-hydroxyphenyl)acetic acid
IUPAC Name: 2,2-bis(4-hydroxyphenyl)acetic acid
SYSTEMATIC NAME: 2,2-bis(4-hydroxyphenyl)ethanoic acid
MOLECULAR FORMULA: C14H12O4
MOLECULAR WEIGHT: 244.24268
SMILES: C1=CC(=CC=C1C(C2=CC=C(C=C2)O)C(=O)O)O
Structure:

CAS RN: 112385-00-9
CAS Name: 2-propenoic acid 2-[2,4,6-trioxo-3,5-bis[2-(1-oxoprop-2-enoxy)ethyl]-1,3,5-triazinan-1-yl]ethyl ester
OPENEYE Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
IUPAC Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2,4,6-tris(oxidanylidene)-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
MOLECULAR FORMULA: C18H21N3O9
MOLECULAR WEIGHT: 423.37404
SMILES: C=CC(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)C=C)CCOC(=O)C=C
Structure:

CAS RN: 115753-22-5
CAS Name: 2-propenoic acid 2-[2,4,6-trioxo-3,5-bis[2-(1-oxoprop-2-enoxy)ethyl]-1,3,5-triazinan-1-yl]ethyl ester
OPENEYE Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
IUPAC Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2,4,6-tris(oxidanylidene)-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
MOLECULAR FORMULA: C18H21N3O9
MOLECULAR WEIGHT: 423.37404
SMILES: C=CC(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)C=C)CCOC(=O)C=C
Structure:

CAS RN: 116107-64-3
CAS Name: 2-propenoic acid 2-[2,4,6-trioxo-3,5-bis[2-(1-oxoprop-2-enoxy)ethyl]-1,3,5-triazinan-1-yl]ethyl ester
OPENEYE Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
IUPAC Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2,4,6-tris(oxidanylidene)-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
MOLECULAR FORMULA: C18H21N3O9
MOLECULAR WEIGHT: 423.37404
SMILES: C=CC(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)C=C)CCOC(=O)C=C
Structure:

CAS RN: 182077-88-9
CAS Name: 2-propenoic acid 2-[2,4,6-trioxo-3,5-bis[2-(1-oxoprop-2-enoxy)ethyl]-1,3,5-triazinan-1-yl]ethyl ester
OPENEYE Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
IUPAC Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2,4,6-tris(oxidanylidene)-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
MOLECULAR FORMULA: C18H21N3O9
MOLECULAR WEIGHT: 423.37404
SMILES: C=CC(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)C=C)CCOC(=O)C=C
Structure:

CAS RN: 40220-08-4
CAS Name: 2-propenoic acid 2-[2,4,6-trioxo-3,5-bis[2-(1-oxoprop-2-enoxy)ethyl]-1,3,5-triazinan-1-yl]ethyl ester
OPENEYE Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
IUPAC Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2,4,6-tris(oxidanylidene)-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
MOLECULAR FORMULA: C18H21N3O9
MOLECULAR WEIGHT: 423.37404
SMILES: C=CC(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)C=C)CCOC(=O)C=C
Structure:

CAS RN: 42033-33-0
CAS Name: 2-propenoic acid 2-[2,4,6-trioxo-3,5-bis[2-(1-oxoprop-2-enoxy)ethyl]-1,3,5-triazinan-1-yl]ethyl ester
OPENEYE Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
IUPAC Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2,4,6-tris(oxidanylidene)-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
MOLECULAR FORMULA: C18H21N3O9
MOLECULAR WEIGHT: 423.37404
SMILES: C=CC(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)C=C)CCOC(=O)C=C
Structure:

CAS RN: 76364-14-2
CAS Name: 2-propenoic acid 2-[2,4,6-trioxo-3,5-bis[2-(1-oxoprop-2-enoxy)ethyl]-1,3,5-triazinan-1-yl]ethyl ester
OPENEYE Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
IUPAC Name: 2-[2,4,6-trioxo-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[2,4,6-tris(oxidanylidene)-3,5-bis(2-prop-2-enoyloxyethyl)-1,3,5-triazinan-1-yl]ethyl prop-2-enoate
MOLECULAR FORMULA: C18H21N3O9
MOLECULAR WEIGHT: 423.37404
SMILES: C=CC(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)C=C)CCOC(=O)C=C
Structure:

CAS RN: 53066-45-8
CAS Name: (2,4-dichloro-5-propan-2-yloxyphenyl)hydrazine
OPENEYE Name: (2,4-dichloro-5-isopropoxy-phenyl)hydrazine
IUPAC Name: (2,4-dichloro-5-propan-2-yloxyphenyl)hydrazine
SYSTEMATIC NAME: [2,4-bis(chloranyl)-5-propan-2-yloxy-phenyl]diazane
MOLECULAR FORMULA: C9H12Cl2N2O
MOLECULAR WEIGHT: 235.11038
SMILES: CC(C)OC1=C(C=C(C(=C1)NN)Cl)Cl
Structure:

CAS RN: 52904-17-3
CAS Name: 1-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]pyrimidine-2,4-dione
OPENEYE Name: 1-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
IUPAC Name: 1-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(2S,3R,4R,5S)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]pyrimidine-2,4-dione
MOLECULAR FORMULA: C9H12N2O6
MOLECULAR WEIGHT: 244.20138
SMILES: C1=CN(C(=O)NC1=O)[C@@H]2[C@@H]([C@H]([C@@H](O2)CO)O)O
Structure:

CAS RN: 40074-34-8
CAS Name: 2-propenoic acid 2-[hydroxy-[2-(1-oxoprop-2-enoxy)ethoxy]phosphoryl]oxyethyl ester
OPENEYE Name: 2-[hydroxy(2-prop-2-enoyloxyethoxy)phosphoryl]oxyethyl prop-2-enoate
IUPAC Name: 2-[hydroxy(2-prop-2-enoyloxyethoxy)phosphoryl]oxyethyl prop-2-enoate
SYSTEMATIC NAME: 2-[oxidanyl(2-prop-2-enoyloxyethoxy)phosphoryl]oxyethyl prop-2-enoate
MOLECULAR FORMULA: C10H15O8P
MOLECULAR WEIGHT: 294.195061
SMILES: C=CC(=O)OCCOP(=O)(O)OCCOC(=O)C=C
Structure:

CAS RN: 40008-96-6
CAS Name: 2-methyl-2-propenoic acid 2-(tert-butylamino)ethyl ester; 2-methyl-2-propenoic acid 2-methylpropyl ester
OPENEYE Name: 2-(tert-butylamino)ethyl 2-methylprop-2-enoate; isobutyl 2-methylprop-2-enoate
IUPAC Name: 2-(tert-butylamino)ethyl 2-methylprop-2-enoate; 2-methylpropyl 2-methylprop-2-enoate
SYSTEMATIC NAME: 2-(tert-butylamino)ethyl 2-methylprop-2-enoate; 2-methylpropyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C18H33NO4
MOLECULAR WEIGHT: 327.45892
SMILES: CC(C)COC(=O)C(=C)C.CC(=C)C(=O)OCCNC(C)(C)C
Structure:

CAS RN: 39984-17-3
CAS Name: 2,3-dihydro-1H-indole-5,6-dione
OPENEYE Name: 2,3-dihydro-1H-indole-5,6-dione
IUPAC Name: 2,3-dihydro-1H-indole-5,6-dione
SYSTEMATIC NAME: 2,3-dihydro-1H-indole-5,6-dione
MOLECULAR FORMULA: C8H7NO2
MOLECULAR WEIGHT: 149.14668
SMILES: C1CNC2=CC(=O)C(=O)C=C21
Structure:

CAS RN: 39921-03-4
CAS Name: furan-2,5-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyloxirane
OPENEYE Name: furan-2,5-dione; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methyloxirane
IUPAC Name: furan-2,5-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyloxirane
SYSTEMATIC NAME: furan-2,5-dione; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyloxirane
MOLECULAR FORMULA: C22H24O6
MOLECULAR WEIGHT: 384.42236
SMILES: CC1CO1.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1=CC(=O)OC1=O
Structure:

CAS RN: 39884-48-5
CAS Name: 4-amino-2-butanol
OPENEYE Name: 4-aminobutan-2-ol
IUPAC Name: 4-aminobutan-2-ol
SYSTEMATIC NAME: 4-azanylbutan-2-ol
MOLECULAR FORMULA: C4H11NO
MOLECULAR WEIGHT: 89.13624
SMILES: CC(CCN)O
Structure:

CAS RN: 127912-49-6
CAS Name: 4-amino-2-butanol
OPENEYE Name: 4-aminobutan-2-ol
IUPAC Name: 4-aminobutan-2-ol
SYSTEMATIC NAME: 4-azanylbutan-2-ol
MOLECULAR FORMULA: C4H11NO
MOLECULAR WEIGHT: 89.13624
SMILES: CC(CCN)O
Structure:

CAS RN: 117380-95-7
CAS Name: (2R)-2-amino-2-phenylacetyl chloride hydrochloride
OPENEYE Name: (2R)-2-amino-2-phenyl-acetyl chloride hydrochloride
IUPAC Name: (2R)-2-amino-2-phenylacetyl chloride hydrochloride
SYSTEMATIC NAME: (2R)-2-azanyl-2-phenyl-ethanoyl chloride hydrochloride
MOLECULAR FORMULA: C8H9Cl2NO
MOLECULAR WEIGHT: 206.06916
SMILES: C1=CC=C(C=C1)[C@H](C(=O)Cl)N.Cl
Structure:

CAS RN: 121658-22-8
CAS Name: (2R)-2-amino-2-phenylacetyl chloride hydrochloride
OPENEYE Name: (2R)-2-amino-2-phenyl-acetyl chloride hydrochloride
IUPAC Name: (2R)-2-amino-2-phenylacetyl chloride hydrochloride
SYSTEMATIC NAME: (2R)-2-azanyl-2-phenyl-ethanoyl chloride hydrochloride
MOLECULAR FORMULA: C8H9Cl2NO
MOLECULAR WEIGHT: 206.06916
SMILES: C1=CC=C(C=C1)[C@H](C(=O)Cl)N.Cl
Structure:

CAS RN: 13598-45-3
CAS Name: hydroxysulfamic acid
OPENEYE Name: hydroxysulfamic acid
IUPAC Name: hydroxysulfamic acid
SYSTEMATIC NAME: oxidanylsulfamic acid
MOLECULAR FORMULA: H3NO4S
MOLECULAR WEIGHT: 113.09312
SMILES: N(O)S(=O)(=O)O
Structure:

CAS RN: 39761-68-7
CAS Name: 2,4,4,6,6-pentamethyl-2-heptene
OPENEYE Name: 2,4,4,6,6-pentamethylhept-2-ene
IUPAC Name: 2,4,4,6,6-pentamethylhept-2-ene
SYSTEMATIC NAME: 2,4,4,6,6-pentamethylhept-2-ene
MOLECULAR FORMULA: C12H24
MOLECULAR WEIGHT: 168.31896
SMILES: CC(=CC(C)(C)CC(C)(C)C)C
Structure:

CAS RN: 39750-11-3
CAS Name: oxido-[2,3,5,6-tetradeuterio-4-(trideuteriomethoxy)phenyl]-[2,3,5,6-tetradeuterio-4-(trideuteriomethoxy)phenyl]iminoammonium
OPENEYE Name: oxido-[2,3,5,6-tetradeuterio-4-(trideuteriomethoxy)phenyl]-[2,3,5,6-tetradeuterio-4-(trideuteriomethoxy)phenyl]imino-ammonium
IUPAC Name: oxido-[2,3,5,6-tetradeuterio-4-(trideuteriomethoxy)phenyl]-[2,3,5,6-tetradeuterio-4-(trideuteriomethoxy)phenyl]iminoazanium
SYSTEMATIC NAME: oxidanidyl-[2,3,5,6-tetradeuterio-4-(trideuteriomethoxy)phenyl]-[2,3,5,6-tetradeuterio-4-(trideuteriomethoxy)phenyl]imino-azanium
MOLECULAR FORMULA: C14H14N2O3
MOLECULAR WEIGHT: 272.358825
SMILES: [2H]C1=C(C(=C(C(=C1N=[N+](C2=C(C(=C(C(=C2[2H])[2H])OC([2H])([2H])[2H])[2H])[2H])[O-])[2H])[2H])OC([2H])([2H])[2H])[2H]
Structure:

CAS RN: 52289-06-2
CAS Name: (2S,5R,9R,10R,13R,17R)-17-[(2S)-3,6-dihydroxy-6-methylheptan-2-yl]-2,14-dihydroxy-10,13-dimethyl-1,2,4,5,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6-dione
OPENEYE Name: (2S,5R,9R,10R,13R,17R)-17-[(1S)-2,5-dihydroxy-1,5-dimethyl-hexyl]-2,14-dihydroxy-10,13-dimethyl-1,2,4,5,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6-dione
IUPAC Name: (2S,5R,9R,10R,13R,17R)-17-[(2S)-3,6-dihydroxy-6-methylheptan-2-yl]-2,14-dihydroxy-10,13-dimethyl-1,2,4,5,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6-dione
SYSTEMATIC NAME: (2S,5R,9R,10R,13R,17R)-10,13-dimethyl-17-[(2S)-6-methyl-3,6-bis(oxidanyl)heptan-2-yl]-2,14-bis(oxidanyl)-1,2,4,5,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6-dione
MOLECULAR FORMULA: C27H42O6
MOLECULAR WEIGHT: 462.61878
SMILES: C[C@@H]([C@H]1CCC2([C@@]1(CC[C@H]3C2=CC(=O)[C@H]4[C@@]3(C[C@@H](C(=O)C4)O)C)C)O)C(CCC(C)(C)O)O
Structure:

CAS RN: 39750-00-0
CAS Name: (2S,5R,9R,10R,13R,17R)-17-[(2S)-3,6-dihydroxy-6-methylheptan-2-yl]-2,14-dihydroxy-10,13-dimethyl-1,2,4,5,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6-dione
OPENEYE Name: (2S,5R,9R,10R,13R,17R)-17-[(1S)-2,5-dihydroxy-1,5-dimethyl-hexyl]-2,14-dihydroxy-10,13-dimethyl-1,2,4,5,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6-dione
IUPAC Name: (2S,5R,9R,10R,13R,17R)-17-[(2S)-3,6-dihydroxy-6-methylheptan-2-yl]-2,14-dihydroxy-10,13-dimethyl-1,2,4,5,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6-dione
SYSTEMATIC NAME: (2S,5R,9R,10R,13R,17R)-10,13-dimethyl-17-[(2S)-6-methyl-3,6-bis(oxidanyl)heptan-2-yl]-2,14-bis(oxidanyl)-1,2,4,5,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6-dione
MOLECULAR FORMULA: C27H42O6
MOLECULAR WEIGHT: 462.61878
SMILES: C[C@@H]([C@H]1CCC2([C@@]1(CC[C@H]3C2=CC(=O)[C@H]4[C@@]3(C[C@@H](C(=O)C4)O)C)C)O)C(CCC(C)(C)O)O
Structure:

CAS RN: 52218-35-6
CAS Name: 2-propenoic acid 2-[4,4-dimethyl-2,5-dioxo-3-[2-(1-oxoprop-2-enoxy)ethyl]-1-imidazolidinyl]ethyl ester
OPENEYE Name: 2-[4,4-dimethyl-2,5-dioxo-3-(2-prop-2-enoyloxyethyl)imidazolidin-1-yl]ethyl prop-2-enoate
IUPAC Name: 2-[4,4-dimethyl-2,5-dioxo-3-(2-prop-2-enoyloxyethyl)imidazolidin-1-yl]ethyl prop-2-enoate
SYSTEMATIC NAME: 2-[4,4-dimethyl-2,5-bis(oxidanylidene)-3-(2-prop-2-enoyloxyethyl)imidazolidin-1-yl]ethyl prop-2-enoate
MOLECULAR FORMULA: C15H20N2O6
MOLECULAR WEIGHT: 324.3291
SMILES: CC1(C(=O)N(C(=O)N1CCOC(=O)C=C)CCOC(=O)C=C)C
Structure:

CAS RN: 39649-71-3
CAS Name: 4-hexoxybenzoyl chloride
OPENEYE Name: 4-hexoxybenzoyl chloride
IUPAC Name: 4-hexoxybenzoyl chloride
SYSTEMATIC NAME: 4-hexoxybenzoyl chloride
MOLECULAR FORMULA: C13H17ClO2
MOLECULAR WEIGHT: 240.72588
SMILES: CCCCCCOC1=CC=C(C=C1)C(=O)Cl
Structure:

CAS RN: 39635-79-5
CAS Name: 2,6-dibromo-4-(3,5-dibromo-4-hydroxyphenyl)sulfonylphenol
OPENEYE Name: 2,6-dibromo-4-(3,5-dibromo-4-hydroxy-phenyl)sulfonyl-phenol
IUPAC Name: 2,6-dibromo-4-(3,5-dibromo-4-hydroxyphenyl)sulfonylphenol
SYSTEMATIC NAME: 4-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]sulfonyl-2,6-bis(bromanyl)phenol
MOLECULAR FORMULA: C12H6Br4O4S
MOLECULAR WEIGHT: 565.85464
SMILES: C1=C(C=C(C(=C1Br)O)Br)S(=O)(=O)C2=CC(=C(C(=C2)Br)O)Br
Structure:

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