Friday, June 29, 2012

http://ChemLookup.com Compounds




CAS RN: 1501-39-9
CAS Name: 2-[(4-methyl-3-oxo-2-quinoxalinyl)methyl]propanedioic acid
OPENEYE Name: 2-[(4-methyl-3-oxo-quinoxalin-2-yl)methyl]propanedioic acid
IUPAC Name: 2-[(4-methyl-3-oxoquinoxalin-2-yl)methyl]propanedioic acid
SYSTEMATIC NAME: 2-[(4-methyl-3-oxidanylidene-quinoxalin-2-yl)methyl]propanedioic acid
MOLECULAR FORMULA: C13H12N2O5
MOLECULAR WEIGHT: 276.24478
SMILES: CN1C2=CC=CC=C2N=C(C1=O)CC(C(=O)O)C(=O)O
Structure:

CAS RN: 1501-73-1
CAS Name: 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioic acid diethyl ester
OPENEYE Name: diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate
IUPAC Name: diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate
SYSTEMATIC NAME: diethyl 2-(3-oxidanylidene-4H-quinoxalin-2-yl)pentanedioate
MOLECULAR FORMULA: C17H20N2O5
MOLECULAR WEIGHT: 332.3511
SMILES: CCOC(=O)CCC(C1=NC2=CC=CC=C2NC1=O)C(=O)OCC
Structure:

CAS RN: 1501-74-2
CAS Name: 2-(3-oxo-4H-quinoxalin-2-yl)butanedioic acid diethyl ester
OPENEYE Name: diethyl 2-(3-oxo-4H-quinoxalin-2-yl)butanedioate
IUPAC Name: diethyl 2-(3-oxo-4H-quinoxalin-2-yl)butanedioate
SYSTEMATIC NAME: diethyl 2-(3-oxidanylidene-4H-quinoxalin-2-yl)butanedioate
MOLECULAR FORMULA: C16H18N2O5
MOLECULAR WEIGHT: 318.32452
SMILES: CCOC(=O)CC(C1=NC2=CC=CC=C2NC1=O)C(=O)OCC
Structure:

CAS RN: 1501-36-6
CAS Name: 2-(3-oxo-4H-quinoxalin-2-yl)octanedioic acid diethyl ester
OPENEYE Name: diethyl 2-(3-oxo-4H-quinoxalin-2-yl)octanedioate
IUPAC Name: diethyl 2-(3-oxo-4H-quinoxalin-2-yl)octanedioate
SYSTEMATIC NAME: diethyl 2-(3-oxidanylidene-4H-quinoxalin-2-yl)octanedioate
MOLECULAR FORMULA: C20H26N2O5
MOLECULAR WEIGHT: 374.43084
SMILES: CCOC(=O)CCCCCC(C1=NC2=CC=CC=C2NC1=O)C(=O)OCC
Structure:

CAS RN: 36235-69-5
CAS Name: 1,3-dimethyl-5,7-dihydropyrrolo[2,3-d]pyrimidine-2,4,6-trione
OPENEYE Name: 1,3-dimethyl-5,7-dihydropyrrolo[2,3-d]pyrimidine-2,4,6-trione
IUPAC Name: 1,3-dimethyl-5,7-dihydropyrrolo[2,3-d]pyrimidine-2,4,6-trione
SYSTEMATIC NAME: 1,3-dimethyl-5,7-dihydropyrrolo[2,3-d]pyrimidine-2,4,6-trione
MOLECULAR FORMULA: C8H9N3O3
MOLECULAR WEIGHT: 195.17536
SMILES: CN1C2=C(CC(=O)N2)C(=O)N(C1=O)C
Structure:

CAS RN: 63630-21-7
CAS Name: 4-hydroxy-3-imino-7-methyl-5,6,7,8-tetrahydroquinoxaline-2-carbonitrile
OPENEYE Name: 4-hydroxy-3-imino-7-methyl-5,6,7,8-tetrahydroquinoxaline-2-carbonitrile
IUPAC Name: 4-hydroxy-3-imino-7-methyl-5,6,7,8-tetrahydroquinoxaline-2-carbonitrile
SYSTEMATIC NAME: 3-azanylidene-7-methyl-4-oxidanyl-5,6,7,8-tetrahydroquinoxaline-2-carbonitrile
MOLECULAR FORMULA: C10H12N4O
MOLECULAR WEIGHT: 204.22848
SMILES: CC1CCC2=C(C1)N=C(C(=N)N2O)C#N
Structure:

CAS RN: 63630-24-0
CAS Name: 3-amino-6-methyl-5,6,7,8-tetrahydroquinoxaline-2-carbonitrile
OPENEYE Name: 3-amino-6-methyl-5,6,7,8-tetrahydroquinoxaline-2-carbonitrile
IUPAC Name: 3-amino-6-methyl-5,6,7,8-tetrahydroquinoxaline-2-carbonitrile
SYSTEMATIC NAME: 3-azanyl-6-methyl-5,6,7,8-tetrahydroquinoxaline-2-carbonitrile
MOLECULAR FORMULA: C10H12N4
MOLECULAR WEIGHT: 188.22908
SMILES: CC1CCC2=NC(=C(N=C2C1)N)C#N
Structure:

CAS RN: 5368-39-8
CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid methyl ester
OPENEYE Name: methyl 3-(4-oxo-1H-quinazolin-2-yl)propanoate
IUPAC Name: methyl 3-(4-oxo-1H-quinazolin-2-yl)propanoate
SYSTEMATIC NAME: methyl 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate
MOLECULAR FORMULA: C12H12N2O3
MOLECULAR WEIGHT: 232.23528
SMILES: COC(=O)CCC1=NC(=O)C2=CC=CC=C2N1
Structure:

CAS RN: 5368-37-6
CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid
OPENEYE Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid
IUPAC Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid
SYSTEMATIC NAME: 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoic acid
MOLECULAR FORMULA: C11H10N2O3
MOLECULAR WEIGHT: 218.2087
SMILES: C1=CC=C2C(=C1)C(=O)N=C(N2)CCC(=O)O
Structure:

CAS RN: 84312-88-9
CAS Name: 3-[4-oxo-3-(phenylmethyl)-2-quinazolinyl]propanoic acid
OPENEYE Name: 3-(3-benzyl-4-oxo-quinazolin-2-yl)propanoic acid
IUPAC Name: 3-(3-benzyl-4-oxoquinazolin-2-yl)propanoic acid
SYSTEMATIC NAME: 3-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propanoic acid
MOLECULAR FORMULA: C18H16N2O3
MOLECULAR WEIGHT: 308.33124
SMILES: C1=CC=C(C=C1)CN2C(=NC3=CC=CC=C3C2=O)CCC(=O)O
Structure:

CAS RN: 51310-21-5
CAS Name: 2-(4-oxo-3-quinazolinyl)benzoic acid methyl ester
OPENEYE Name: methyl 2-(4-oxoquinazolin-3-yl)benzoate
IUPAC Name: methyl 2-(4-oxoquinazolin-3-yl)benzoate
SYSTEMATIC NAME: methyl 2-(4-oxidanylidenequinazolin-3-yl)benzoate
MOLECULAR FORMULA: C16H12N2O3
MOLECULAR WEIGHT: 280.27808
SMILES: COC(=O)C1=CC=CC=C1N2C=NC3=CC=CC=C3C2=O
Structure:

CAS RN: 32601-90-4
CAS Name: 2-(dibromomethyl)quinoxaline
OPENEYE Name: 2-(dibromomethyl)quinoxaline
IUPAC Name: 2-(dibromomethyl)quinoxaline
SYSTEMATIC NAME: 2-[bis(bromanyl)methyl]quinoxaline
MOLECULAR FORMULA: C9H6Br2N2
MOLECULAR WEIGHT: 301.96534
SMILES: C1=CC=C2C(=C1)N=CC(=N2)C(Br)Br
Structure:

CAS RN: 1204-74-6
CAS Name: 3-oxo-2,4-dihydro-1H-quinoxaline-2-carboxylic acid
OPENEYE Name: 3-oxo-2,4-dihydro-1H-quinoxaline-2-carboxylic acid
IUPAC Name: 3-oxo-2,4-dihydro-1H-quinoxaline-2-carboxylic acid
SYSTEMATIC NAME: 3-oxidanylidene-2,4-dihydro-1H-quinoxaline-2-carboxylic acid
MOLECULAR FORMULA: C9H8N2O3
MOLECULAR WEIGHT: 192.17142
SMILES: C1=CC=C2C(=C1)NC(C(=O)N2)C(=O)O
Structure:

CAS RN: 35883-52-4
CAS Name: 5,6-diphenyl-1,2,4-triazine-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 5,6-diphenyl-1,2,4-triazine-3-carboxylate
IUPAC Name: ethyl 5,6-diphenyl-1,2,4-triazine-3-carboxylate
SYSTEMATIC NAME: ethyl 5,6-diphenyl-1,2,4-triazine-3-carboxylate
MOLECULAR FORMULA: C18H15N3O2
MOLECULAR WEIGHT: 305.3306
SMILES: CCOC(=O)C1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3
Structure:

CAS RN: 64949-81-1
CAS Name: 2-[(3-acetamido-1-oxopropyl)amino]-3-mercaptopropanoic acid ethyl ester
OPENEYE Name: ethyl 2-(3-acetamidopropanoylamino)-3-sulfanyl-propanoate
IUPAC Name: ethyl 2-(3-acetamidopropanoylamino)-3-sulfanylpropanoate
SYSTEMATIC NAME: ethyl 2-(3-acetamidopropanoylamino)-3-sulfanyl-propanoate
MOLECULAR FORMULA: C10H18N2O4S
MOLECULAR WEIGHT: 262.32592
SMILES: CCOC(=O)C(CS)NC(=O)CCNC(=O)C
Structure:

CAS RN: 62563-06-8
CAS Name: 6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylic acid dimethyl ester
OPENEYE Name: dimethyl 6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate
IUPAC Name: dimethyl 6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate
SYSTEMATIC NAME: dimethyl 6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate
MOLECULAR FORMULA: C11H13NO4
MOLECULAR WEIGHT: 223.22522
SMILES: COC(=O)C1=CN2CCCC2=C1C(=O)OC
Structure:

CAS RN: 685-80-3
CAS Name: 2-bromo-3-fluorobutanedioic acid diethyl ester
OPENEYE Name: diethyl 2-bromo-3-fluoro-butanedioate
IUPAC Name: diethyl 2-bromo-3-fluorobutanedioate
SYSTEMATIC NAME: diethyl 2-bromanyl-3-fluoranyl-butanedioate
MOLECULAR FORMULA: C8H12BrFO4
MOLECULAR WEIGHT: 271.080883
SMILES: CCOC(=O)C(C(C(=O)OCC)Br)F
Structure:

CAS RN: 1992-93-4
CAS Name: 2-bromo-3-fluorobutanedioic acid dimethyl ester
OPENEYE Name: dimethyl 2-bromo-3-fluoro-butanedioate
IUPAC Name: dimethyl 2-bromo-3-fluorobutanedioate
SYSTEMATIC NAME: dimethyl 2-bromanyl-3-fluoranyl-butanedioate
MOLECULAR FORMULA: C6H8BrFO4
MOLECULAR WEIGHT: 243.027723
SMILES: COC(=O)C(C(C(=O)OC)Br)F
Structure:

CAS RN: 36875-34-0
CAS Name: 2-bromo-3-fluorobutanedioic acid dimethyl ester
OPENEYE Name: dimethyl 2-bromo-3-fluoro-butanedioate
IUPAC Name: dimethyl 2-bromo-3-fluorobutanedioate
SYSTEMATIC NAME: dimethyl 2-bromanyl-3-fluoranyl-butanedioate
MOLECULAR FORMULA: C6H8BrFO4
MOLECULAR WEIGHT: 243.027723
SMILES: COC(=O)C(C(C(=O)OC)Br)F
Structure:

CAS RN: 10160-46-0
CAS Name: phosphoric acid (2-methylpropan-2-yl)oxy dipropan-2-yl ester
OPENEYE Name: tert-butoxy diisopropyl phosphate
IUPAC Name: (2-methylpropan-2-yl)oxy dipropan-2-yl phosphate
SYSTEMATIC NAME: (2-methylpropan-2-yl)oxy dipropan-2-yl phosphate
MOLECULAR FORMULA: C10H23O5P
MOLECULAR WEIGHT: 254.260381
SMILES: CC(C)OP(=O)(OC(C)C)OOC(C)(C)C
Structure:

CAS RN: 61384-33-6
CAS Name: 4-[1-aziridinyl-[(1-hydroxy-2,2,6,6-tetramethyl-4-piperidinyl)oxy]phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
OPENEYE Name: 4-[aziridin-1-yl-[(1-hydroxy-2,2,6,6-tetramethyl-4-piperidyl)oxy]phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethyl-piperidine
IUPAC Name: 4-[aziridin-1-yl-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyphosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
SYSTEMATIC NAME: 4-[aziridin-1-yl-(2,2,6,6-tetramethyl-1-oxidanyl-piperidin-4-yl)oxy-phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidanyl-piperidine
MOLECULAR FORMULA: C20H40N3O5P
MOLECULAR WEIGHT: 433.522461
SMILES: CC1(CC(CC(N1O)(C)C)OP(=O)(N2CC2)OC3CC(N(C(C3)(C)C)O)(C)C)C
Structure:

CAS RN: 64566-87-6
CAS Name: 4-[1-aziridinyl-[(1-hydroxy-2,2,6,6-tetramethyl-4-piperidinyl)oxy]phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
OPENEYE Name: 4-[aziridin-1-yl-[(1-hydroxy-2,2,6,6-tetramethyl-4-piperidyl)oxy]phosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethyl-piperidine
IUPAC Name: 4-[aziridin-1-yl-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyphosphoryl]oxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
SYSTEMATIC NAME: 4-[aziridin-1-yl-(2,2,6,6-tetramethyl-1-oxidanyl-piperidin-4-yl)oxy-phosphoryl]oxy-2,2,6,6-tetramethyl-1-oxidanyl-piperidine
MOLECULAR FORMULA: C20H40N3O5P
MOLECULAR WEIGHT: 433.522461
SMILES: CC1(CC(CC(N1O)(C)C)OP(=O)(N2CC2)OC3CC(N(C(C3)(C)C)O)(C)C)C
Structure:

CAS RN: 27091-68-5
CAS Name: N-[(2,6-dimethyl-4-oxo-3-pyranyl)-oxomethyl]carbamic acid ethyl ester
OPENEYE Name: ethyl N-(2,6-dimethyl-4-oxo-pyran-3-carbonyl)carbamate
IUPAC Name: ethyl N-(2,6-dimethyl-4-oxopyran-3-carbonyl)carbamate
SYSTEMATIC NAME: ethyl N-(2,6-dimethyl-4-oxidanylidene-pyran-3-yl)carbonylcarbamate
MOLECULAR FORMULA: C11H13NO5
MOLECULAR WEIGHT: 239.22462
SMILES: CCOC(=O)NC(=O)C1=C(OC(=CC1=O)C)C
Structure:

CAS RN: 4046-39-3
CAS Name: 2-[[4-(2-carboxyanilino)-3,6-dioxo-1-cyclohexa-1,4-dienyl]amino]benzoic acid
OPENEYE Name: 2-[[4-(2-carboxyanilino)-3,6-dioxo-cyclohexa-1,4-dien-1-yl]amino]benzoic acid
IUPAC Name: 2-[[4-(2-carboxyanilino)-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]benzoic acid
SYSTEMATIC NAME: 2-[[4-[(2-carboxyphenyl)amino]-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]amino]benzoic acid
MOLECULAR FORMULA: C20H14N2O6
MOLECULAR WEIGHT: 378.33496
SMILES: C1=CC=C(C(=C1)C(=O)O)NC2=CC(=O)C(=CC2=O)NC3=CC=CC=C3C(=O)O
Structure:

CAS RN: 16508-61-5
CAS Name: 1-[4-(1,3-dioxo-2-isoindolyl)phenyl]sulfonyl-3-(hydroxymethyl)urea
OPENEYE Name: 1-[4-(1,3-dioxoisoindolin-2-yl)phenyl]sulfonyl-3-(hydroxymethyl)urea
IUPAC Name: 1-[4-(1,3-dioxoisoindol-2-yl)phenyl]sulfonyl-3-(hydroxymethyl)urea
SYSTEMATIC NAME: 1-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]sulfonyl-3-(hydroxymethyl)urea
MOLECULAR FORMULA: C16H13N3O6S
MOLECULAR WEIGHT: 375.35592
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)S(=O)(=O)NC(=O)NCO
Structure:

CAS RN: 59886-43-0
CAS Name: 2,5-bis(1-aziridinyl)-3,6-bis(1-piperidinyl)cyclohexa-2,5-diene-1,4-dione
OPENEYE Name: 2,5-bis(aziridin-1-yl)-3,6-bis(1-piperidyl)-1,4-benzoquinone
IUPAC Name: 2,5-bis(aziridin-1-yl)-3,6-di(piperidin-1-yl)cyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2,5-bis(aziridin-1-yl)-3,6-di(piperidin-1-yl)cyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C20H28N4O2
MOLECULAR WEIGHT: 356.46192
SMILES: C1CCN(CC1)C2=C(C(=O)C(=C(C2=O)N3CC3)N4CCCCC4)N5CC5
Structure:

CAS RN: 59886-41-8
CAS Name: 2,5-bis(1-aziridinyl)-3,6-bis(4-morpholinyl)cyclohexa-2,5-diene-1,4-dione
OPENEYE Name: 2,5-bis(aziridin-1-yl)-3,6-dimorpholino-1,4-benzoquinone
IUPAC Name: 2,5-bis(aziridin-1-yl)-3,6-dimorpholin-4-ylcyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2,5-bis(aziridin-1-yl)-3,6-dimorpholin-4-yl-cyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C18H24N4O4
MOLECULAR WEIGHT: 360.40756
SMILES: C1CN1C2=C(C(=O)C(=C(C2=O)N3CCOCC3)N4CC4)N5CCOCC5
Structure:

CAS RN: 79692-18-5
CAS Name: N4-[4-[5-(diethylamino)pentan-2-ylamino]butyl]-N1,N1-diethylpentane-1,4-diamine
OPENEYE Name: N4-[4-[[4-(diethylamino)-1-methyl-butyl]amino]butyl]-N1,N1-diethyl-pentane-1,4-diamine
IUPAC Name: 4-N-[4-[5-(diethylamino)pentan-2-ylamino]butyl]-1-N,1-N-diethylpentane-1,4-diamine
SYSTEMATIC NAME: N4-[4-[5-(diethylamino)pentan-2-ylamino]butyl]-N1,N1-diethyl-pentane-1,4-diamine
MOLECULAR FORMULA: C22H50N4
MOLECULAR WEIGHT: 370.6592
SMILES: CCN(CC)CCCC(C)NCCCCNC(C)CCCN(CC)CC
Structure:

CAS RN: 70539-56-9
CAS Name: 2-[[[4-[(2,4-diamino-6-pteridinyl)methylamino]phenyl]-oxomethyl]amino]heptanedioic acid
OPENEYE Name: 2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]heptanedioic acid
IUPAC Name: 2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]heptanedioic acid
SYSTEMATIC NAME: 2-[[4-[[2,4-bis(azanyl)pteridin-6-yl]methylamino]phenyl]carbonylamino]heptanedioic acid
MOLECULAR FORMULA: C21H24N8O5
MOLECULAR WEIGHT: 468.46586
SMILES: C1=CC(=CC=C1C(=O)NC(CCCCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=NC(=N3)N)N
Structure:

CAS RN: 60432-54-4
CAS Name: 5-(benzenesulfonyl)-10H-indeno[1,2-b]indole
OPENEYE Name: 5-(benzenesulfonyl)-10H-indeno[1,2-b]indole
IUPAC Name: 5-(benzenesulfonyl)-10H-indeno[1,2-b]indole
SYSTEMATIC NAME: 5-(phenylsulfonyl)-10H-indeno[1,2-b]indole
MOLECULAR FORMULA: C21H15NO2S
MOLECULAR WEIGHT: 345.4143
SMILES: C1C2=CC=CC=C2C3=C1C4=CC=CC=C4N3S(=O)(=O)C5=CC=CC=C5
Structure:

CAS RN: 66568-83-0
CAS Name: acetic acid [3,4,5-triacetyloxy-6-[[(7S)-1,2,3-trimethoxy-10-(methylthio)-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]amino]-2-oxanyl]methyl ester
OPENEYE Name: [3,4,5-triacetoxy-6-[[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]amino]tetrahydropyran-2-yl]methyl acetate
IUPAC Name: [3,4,5-triacetyloxy-6-[[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]amino]oxan-2-yl]methyl acetate
SYSTEMATIC NAME: [3,4,5-triacetyloxy-6-[[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl]amino]oxan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C34H41NO13S
MOLECULAR WEIGHT: 703.75324
SMILES: CC(=O)OCC1C(C(C(C(O1)N[C@H]2CCC3=CC(=C(C(=C3C4=CC=C(C(=O)C=C24)SC)OC)OC)OC)OC(=O)C)OC(=O)C)OC(=O)C
Structure:

CAS RN: 28832-07-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H21NO4
MOLECULAR WEIGHT: 339.38504
SMILES: CN1CCC2=CC3=C(C4=C2[C@H]1CC5=CC(=C(C=C54)OC)OC)OCO3
Structure:

CAS RN: 71035-02-4
CAS Name: octacosanoic acid 2,3-dihydroxypropyl ester
OPENEYE Name: 2,3-dihydroxypropyl octacosanoate
IUPAC Name: 2,3-dihydroxypropyl octacosanoate
SYSTEMATIC NAME: 2,3-bis(oxidanyl)propyl octacosanoate
MOLECULAR FORMULA: C31H62O4
MOLECULAR WEIGHT: 498.82158
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CO)O
Structure:

CAS RN: 35609-28-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H34O7
MOLECULAR WEIGHT: 458.54396
SMILES: CC12CCC3C(C1(CC(C2C4=COC(=O)C=C4)O)O)CCC56C3(C7CC(C5)OC(O7)(O6)C)C
Structure:

CAS RN: 30344-97-9
CAS Name: 5,14,16-trihydroxy-13-methyl-17-(6-oxo-3-pyranyl)-2,6,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-10-carboxaldehyde
OPENEYE Name: 5,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,6,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
IUPAC Name: 5,14,16-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,6,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
SYSTEMATIC NAME: 13-methyl-5,14,16-tris(oxidanyl)-17-(6-oxidanylidenepyran-3-yl)-2,6,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
MOLECULAR FORMULA: C24H30O6
MOLECULAR WEIGHT: 414.4914
SMILES: CC12CCC3C(C1(CC(C2C4=COC(=O)C=C4)O)O)CCC5(C3(CCC=C5)C=O)O
Structure:

CAS RN: 51838-83-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H16O7
MOLECULAR WEIGHT: 308.28334
SMILES: CC(C1C2C3(C=CC4C3C(O2)OC=C4C(=O)OC)OC1=O)O
Structure:

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