CAS RN: 101859-55-6
CAS Name: (E)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]-2-penten-1-ol
OPENEYE Name: (E)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]pent-2-en-1-ol
IUPAC Name: (E)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]pent-2-en-1-ol
SYSTEMATIC NAME: (E)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]pent-2-en-1-ol
MOLECULAR FORMULA: C24H28Cl2O2
MOLECULAR WEIGHT: 419.38392
SMILES: C1CC[C@H]([C@@H](C1)CC/C=C/CO)OC(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 101859-54-5
CAS Name: (Z)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]-2-pentenoic acid methyl ester
OPENEYE Name: methyl (Z)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]pent-2-enoate
IUPAC Name: methyl (Z)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]pent-2-enoate
SYSTEMATIC NAME: methyl (Z)-5-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]pent-2-enoate
MOLECULAR FORMULA: C25H28Cl2O3
MOLECULAR WEIGHT: 447.39402
SMILES: COC(=O)/C=C\CC[C@@H]1CCCC[C@H]1OC(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 101859-51-2
CAS Name: 2,4-dichlorobenzoic acid [(E)-5-[(1R,2S)-2-[(2,6-dichlorophenyl)methoxy]cyclohexyl]pent-2-enyl] ester
OPENEYE Name: [(E)-5-[(1R,2S)-2-[(2,6-dichlorophenyl)methoxy]cyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
IUPAC Name: [(E)-5-[(1R,2S)-2-[(2,6-dichlorophenyl)methoxy]cyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
SYSTEMATIC NAME: [(E)-5-[(1R,2S)-2-[[2,6-bis(chloranyl)phenyl]methoxy]cyclohexyl]pent-2-enyl] 2,4-bis(chloranyl)benzoate
MOLECULAR FORMULA: C25H26Cl4O3
MOLECULAR WEIGHT: 516.28414
SMILES: C1CC[C@@H]([C@H](C1)CC/C=C/COC(=O)C2=C(C=C(C=C2)Cl)Cl)OCC3=C(C=CC=C3Cl)Cl
Structure:
CAS RN: 101859-50-1
CAS Name: (E)-5-[(1R,2S)-2-[(2,6-dichlorophenyl)methoxy]cyclohexyl]-2-penten-1-ol
OPENEYE Name: (E)-5-[(1R,2S)-2-[(2,6-dichlorophenyl)methoxy]cyclohexyl]pent-2-en-1-ol
IUPAC Name: (E)-5-[(1R,2S)-2-[(2,6-dichlorophenyl)methoxy]cyclohexyl]pent-2-en-1-ol
SYSTEMATIC NAME: (E)-5-[(1R,2S)-2-[[2,6-bis(chloranyl)phenyl]methoxy]cyclohexyl]pent-2-en-1-ol
MOLECULAR FORMULA: C18H24Cl2O2
MOLECULAR WEIGHT: 343.28796
SMILES: C1CC[C@@H]([C@H](C1)CC/C=C/CO)OCC2=C(C=CC=C2Cl)Cl
Structure:
CAS RN: 101859-49-8
CAS Name: (2S)-2-[(E)-5-[(1R)-2-[(2,6-dichlorophenyl)methoxy]cyclohexyl]pent-2-enoxy]oxane
OPENEYE Name: (2S)-2-[(E)-5-[(1R)-2-[(2,6-dichlorophenyl)methoxy]cyclohexyl]pent-2-enoxy]tetrahydropyran
IUPAC Name: (2S)-2-[(E)-5-[(1R)-2-[(2,6-dichlorophenyl)methoxy]cyclohexyl]pent-2-enoxy]oxane
SYSTEMATIC NAME: (2S)-2-[(E)-5-[(1R)-2-[[2,6-bis(chloranyl)phenyl]methoxy]cyclohexyl]pent-2-enoxy]oxane
MOLECULAR FORMULA: C23H32Cl2O3
MOLECULAR WEIGHT: 427.40438
SMILES: C1CCC([C@H](C1)CC/C=C/CO[C@H]2CCCCO2)OCC3=C(C=CC=C3Cl)Cl
Structure:
CAS RN: 101859-48-7
CAS Name: (E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]-2-penten-1-ol
OPENEYE Name: (E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-en-1-ol
IUPAC Name: (E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-en-1-ol
SYSTEMATIC NAME: (E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-en-1-ol
MOLECULAR FORMULA: C18H25BrO2
MOLECULAR WEIGHT: 353.2939
SMILES: C1CC[C@@H]([C@H](C1)CC/C=C/CO)OCC2=CC=C(C=C2)Br
Structure:
CAS RN: 101859-47-6
CAS Name: (Z)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]-2-pentenoic acid methyl ester
OPENEYE Name: methyl (Z)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
IUPAC Name: methyl (Z)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
SYSTEMATIC NAME: methyl (Z)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
MOLECULAR FORMULA: C19H25BrO3
MOLECULAR WEIGHT: 381.304
SMILES: COC(=O)/C=C\CC[C@H]1CCCC[C@@H]1OCC2=CC=C(C=C2)Br
Structure:
CAS RN: 101859-44-3
CAS Name: 2,4-dichlorobenzoic acid [(E)-5-[(1R,2S)-2-phenylmethoxycyclohexyl]pent-2-enyl] ester
OPENEYE Name: [(E)-5-[(1R,2S)-2-benzyloxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
IUPAC Name: [(E)-5-[(1R,2S)-2-phenylmethoxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
SYSTEMATIC NAME: [(E)-5-[(1R,2S)-2-phenylmethoxycyclohexyl]pent-2-enyl] 2,4-bis(chloranyl)benzoate
MOLECULAR FORMULA: C25H28Cl2O3
MOLECULAR WEIGHT: 447.39402
SMILES: C1CC[C@@H]([C@H](C1)CC/C=C/COC(=O)C2=C(C=C(C=C2)Cl)Cl)OCC3=CC=CC=C3
Structure:
CAS RN: 101859-43-2
CAS Name: (E)-5-[(1R,2S)-2-phenylmethoxycyclohexyl]-2-penten-1-ol
OPENEYE Name: (E)-5-[(1R,2S)-2-benzyloxycyclohexyl]pent-2-en-1-ol
IUPAC Name: (E)-5-[(1R,2S)-2-phenylmethoxycyclohexyl]pent-2-en-1-ol
SYSTEMATIC NAME: (E)-5-[(1R,2S)-2-phenylmethoxycyclohexyl]pent-2-en-1-ol
MOLECULAR FORMULA: C18H26O2
MOLECULAR WEIGHT: 274.39784
SMILES: C1CC[C@@H]([C@H](C1)CC/C=C/CO)OCC2=CC=CC=C2
Structure:
CAS RN: 101859-42-1
CAS Name: (2S)-2-[(E)-5-[(1R)-2-phenylmethoxycyclohexyl]pent-2-enoxy]oxane
OPENEYE Name: (2S)-2-[(E)-5-[(1R)-2-benzyloxycyclohexyl]pent-2-enoxy]tetrahydropyran
IUPAC Name: (2S)-2-[(E)-5-[(1R)-2-phenylmethoxycyclohexyl]pent-2-enoxy]oxane
SYSTEMATIC NAME: (2S)-2-[(E)-5-[(1R)-2-phenylmethoxycyclohexyl]pent-2-enoxy]oxane
MOLECULAR FORMULA: C23H34O3
MOLECULAR WEIGHT: 358.51426
SMILES: C1CCC([C@H](C1)CC/C=C/CO[C@H]2CCCCO2)OCC3=CC=CC=C3
Structure:
CAS RN: 101859-41-0
CAS Name: (1S,2R)-2-[(E)-5-(2-oxanyloxy)pent-3-enyl]-1-cyclohexanol
OPENEYE Name: (1S,2R)-2-[(E)-5-tetrahydropyran-2-yloxypent-3-enyl]cyclohexanol
IUPAC Name: (1S,2R)-2-[(E)-5-(oxan-2-yloxy)pent-3-enyl]cyclohexan-1-ol
SYSTEMATIC NAME: (1S,2R)-2-[(E)-5-(oxan-2-yloxy)pent-3-enyl]cyclohexan-1-ol
MOLECULAR FORMULA: C16H28O3
MOLECULAR WEIGHT: 268.39172
SMILES: C1CC[C@@H]([C@H](C1)CC/C=C/COC2CCCCO2)O
Structure:
CAS RN: 101859-40-9
CAS Name: tert-butyl-dimethyl-[(1S,2R)-2-[(E)-5-(2-oxanyloxy)pent-3-enyl]cyclohexyl]oxysilane
OPENEYE Name: tert-butyl-dimethyl-[(1S,2R)-2-[(E)-5-tetrahydropyran-2-yloxypent-3-enyl]cyclohexoxy]silane
IUPAC Name: tert-butyl-dimethyl-[(1S,2R)-2-[(E)-5-(oxan-2-yloxy)pent-3-enyl]cyclohexyl]oxysilane
SYSTEMATIC NAME: tert-butyl-dimethyl-[(1S,2R)-2-[(E)-5-(oxan-2-yloxy)pent-3-enyl]cyclohexyl]oxy-silane
MOLECULAR FORMULA: C22H42O3Si
MOLECULAR WEIGHT: 382.65258
SMILES: CC(C)(C)[Si](C)(C)O[C@H]1CCCC[C@@H]1CC/C=C/COC2CCCCO2
Structure:
CAS RN: 101859-39-6
CAS Name: (E)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]-2-penten-1-ol
OPENEYE Name: (E)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-en-1-ol
IUPAC Name: (E)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-en-1-ol
SYSTEMATIC NAME: (E)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-en-1-ol
MOLECULAR FORMULA: C17H34O2Si
MOLECULAR WEIGHT: 298.53616
SMILES: CC(C)(C)[Si](C)(C)O[C@H]1CCCC[C@@H]1CC/C=C/CO
Structure:
CAS RN: 101859-38-5
CAS Name: 2,4-dichlorobenzoic acid [(Z)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-enyl] ester
OPENEYE Name: [(Z)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
IUPAC Name: [(Z)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
SYSTEMATIC NAME: [(Z)-5-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]pent-2-enyl] 2,4-bis(chloranyl)benzoate
MOLECULAR FORMULA: C24H36Cl2O3Si
MOLECULAR WEIGHT: 471.53234
SMILES: CC(C)(C)[Si](C)(C)O[C@H]1CCCC[C@@H]1CC/C=C\COC(=O)C2=C(C=C(C=C2)Cl)Cl
Structure:
CAS RN: 99964-84-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H33N3O6
MOLECULAR WEIGHT: 519.58882
SMILES: CC(=O)N1CCCCNC(=O)/C=C\C2=CC(=C(C=C2)OC(=O)C)OC3=CC=C(C=C3)/C=C/C(=O)NCCC1
Structure:
CAS RN: 99964-83-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H29N3O4
MOLECULAR WEIGHT: 435.51546
SMILES: C1CCNC(=O)/C=C\C2=CC(=C(C=C2)O)OC3=CC=C(C=C3)/C=C/C(=O)NCCCNC1
Structure:
CAS RN: 99903-54-5
CAS Name: (1R,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-bis(trifluoromethyl)-1-cyclopropanecarboxylic acid
OPENEYE Name: (1R,3S)-3-[(Z)-2-chloro-3,3,3-trifluoro-prop-1-enyl]-2,2-bis(trifluoromethyl)cyclopropanecarboxylic acid
IUPAC Name: (1R,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylic acid
SYSTEMATIC NAME: (1R,3S)-3-[(Z)-2-chloranyl-3,3,3-tris(fluoranyl)prop-1-enyl]-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylic acid
MOLECULAR FORMULA: C9H4ClF9O2
MOLECULAR WEIGHT: 350.565489
SMILES: C(=C(/C(F)(F)F)\Cl)\[C@@H]1[C@H](C1(C(F)(F)F)C(F)(F)F)C(=O)O
Structure:
CAS RN: 99903-51-2
CAS Name: (1R,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-bis(trifluoromethyl)-1-cyclopropanecarboxylic acid ethyl ester
OPENEYE Name: ethyl (1R,3S)-3-[(Z)-2-chloro-3,3,3-trifluoro-prop-1-enyl]-2,2-bis(trifluoromethyl)cyclopropanecarboxylate
IUPAC Name: ethyl (1R,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate
SYSTEMATIC NAME: ethyl (1R,3S)-3-[(Z)-2-chloranyl-3,3,3-tris(fluoranyl)prop-1-enyl]-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate
MOLECULAR FORMULA: C11H8ClF9O2
MOLECULAR WEIGHT: 378.618649
SMILES: CCOC(=O)[C@@H]1[C@H](C1(C(F)(F)F)C(F)(F)F)/C=C(/C(F)(F)F)\Cl
Structure:
CAS RN: 99877-53-9
CAS Name: (1R,2S,3R)-3-[(5E)-7-hydroxy-6-methylhepta-1,5-dien-2-yl]-1,2-dimethyl-1-cyclopentanol
OPENEYE Name: (1R,2S,3R)-3-[(E)-6-hydroxy-5-methyl-1-methylene-hex-4-enyl]-1,2-dimethyl-cyclopentanol
IUPAC Name: (1R,2S,3R)-3-[(5E)-7-hydroxy-6-methylhepta-1,5-dien-2-yl]-1,2-dimethylcyclopentan-1-ol
SYSTEMATIC NAME: (1R,2S,3R)-1,2-dimethyl-3-[(5E)-6-methyl-7-oxidanyl-hepta-1,5-dien-2-yl]cyclopentan-1-ol
MOLECULAR FORMULA: C15H26O2
MOLECULAR WEIGHT: 238.36574
SMILES: C[C@H]1[C@@H](CC[C@@]1(C)O)C(=C)CC/C=C(\C)/CO
Structure:
CAS RN: 99838-22-9
CAS Name: (Z)-N,N-dimethyl-3-phenyl-2-propen-1-amine hydrochloride
OPENEYE Name: (Z)-N,N-dimethyl-3-phenyl-prop-2-en-1-amine hydrochloride
IUPAC Name: (Z)-N,N-dimethyl-3-phenylprop-2-en-1-amine hydrochloride
SYSTEMATIC NAME: (Z)-N,N-dimethyl-3-phenyl-prop-2-en-1-amine hydrochloride
MOLECULAR FORMULA: C11H16ClN
MOLECULAR WEIGHT: 197.70444
SMILES: CN(C)C/C=C\C1=CC=CC=C1.Cl
Structure:
CAS RN: 61229-09-2
CAS Name: (E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-6-methyl-4-heptenamide
OPENEYE Name: (E)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]-6-methyl-hept-4-enamide
IUPAC Name: (E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-6-methylhept-4-enamide
SYSTEMATIC NAME: (E)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-6-methyl-hept-4-enamide
MOLECULAR FORMULA: C16H23NO3
MOLECULAR WEIGHT: 277.35872
SMILES: CC(C)/C=C/CCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 61229-08-1
CAS Name: (E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-7-methyl-5-octenamide
OPENEYE Name: (E)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]-7-methyl-oct-5-enamide
IUPAC Name: (E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-7-methyloct-5-enamide
SYSTEMATIC NAME: (E)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-7-methyl-oct-5-enamide
MOLECULAR FORMULA: C17H25NO3
MOLECULAR WEIGHT: 291.3853
SMILES: CC(C)/C=C/CCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 61229-07-0
CAS Name: (E)-6-methyl-4-heptenoic acid
OPENEYE Name: (E)-6-methylhept-4-enoic acid
IUPAC Name: (E)-6-methylhept-4-enoic acid
SYSTEMATIC NAME: (E)-6-methylhept-4-enoic acid
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: CC(C)/C=C/CCC(=O)O
Structure:
CAS RN: 61229-06-9
CAS Name: (E)-7-methyl-5-octenoic acid
OPENEYE Name: (E)-7-methyloct-5-enoic acid
IUPAC Name: (E)-7-methyloct-5-enoic acid
SYSTEMATIC NAME: (E)-7-methyloct-5-enoic acid
MOLECULAR FORMULA: C9H16O2
MOLECULAR WEIGHT: 156.22214
SMILES: CC(C)/C=C/CCCC(=O)O
Structure:
CAS RN: 61229-05-8
CAS Name: (E)-9-methyl-7-decenoic acid
OPENEYE Name: (E)-9-methyldec-7-enoic acid
IUPAC Name: (E)-9-methyldec-7-enoic acid
SYSTEMATIC NAME: (E)-9-methyldec-7-enoic acid
MOLECULAR FORMULA: C11H20O2
MOLECULAR WEIGHT: 184.2753
SMILES: CC(C)/C=C/CCCCCC(=O)O
Structure:
CAS RN: 61036-49-5
CAS Name: (2E,4E,7S,8E,10E,14S)-7-hydroxy-8,14-dimethylhexadeca-2,4,8,10-tetraenoic acid [(3'R,4'S,5'R,6'R)-3',4,5',6-tetrahydroxy-6'-(hydroxymethyl)-4'-spiro[1H-isobenzofuran-3,2'-oxane]yl] ester
OPENEYE Name: [(3'R,4'S,5'R,6'R)-3',4,5',6-tetrahydroxy-6'-(hydroxymethyl)spiro[1H-isobenzofuran-3,2'-tetrahydropyran]-4'-yl] (2E,4E,7S,8E,10E,14S)-7-hydroxy-8,14-dimethyl-hexadeca-2,4,8,10-tetraenoate
IUPAC Name: [(3'R,4'S,5'R,6'R)-3',4,5',6-tetrahydroxy-6'-(hydroxymethyl)spiro[1H-2-benzofuran-3,2'-oxane]-4'-yl] (2E,4E,7S,8E,10E,14S)-7-hydroxy-8,14-dimethylhexadeca-2,4,8,10-tetraenoate
SYSTEMATIC NAME: [(3'R,4'S,5'R,6'R)-6'-(hydroxymethyl)-3',4,5',6-tetrakis(oxidanyl)spiro[1H-2-benzofuran-3,2'-oxane]-4'-yl] (2E,4E,7S,8E,10E,14S)-8,14-dimethyl-7-oxidanyl-hexadeca-2,4,8,10-tetraenoate
MOLECULAR FORMULA: C31H42O10
MOLECULAR WEIGHT: 574.65918
SMILES: CC[C@H](C)CC/C=C/C=C(\C)/[C@H](C/C=C/C=C/C(=O)O[C@H]1[C@@H]([C@H](OC2([C@@H]1O)C3=C(C=C(C=C3CO2)O)O)CO)O)O
Structure:
CAS RN: 74233-56-0
CAS Name: (2E,4E,7S,8E,10E,14S)-7-hydroxy-8,14-dimethylhexadeca-2,4,8,10-tetraenoic acid [(3'R,4'S,5'R,6'R)-3',4,5',6-tetrahydroxy-6'-(hydroxymethyl)-4'-spiro[1H-isobenzofuran-3,2'-oxane]yl] ester
OPENEYE Name: [(3'R,4'S,5'R,6'R)-3',4,5',6-tetrahydroxy-6'-(hydroxymethyl)spiro[1H-isobenzofuran-3,2'-tetrahydropyran]-4'-yl] (2E,4E,7S,8E,10E,14S)-7-hydroxy-8,14-dimethyl-hexadeca-2,4,8,10-tetraenoate
IUPAC Name: [(3'R,4'S,5'R,6'R)-3',4,5',6-tetrahydroxy-6'-(hydroxymethyl)spiro[1H-2-benzofuran-3,2'-oxane]-4'-yl] (2E,4E,7S,8E,10E,14S)-7-hydroxy-8,14-dimethylhexadeca-2,4,8,10-tetraenoate
SYSTEMATIC NAME: [(3'R,4'S,5'R,6'R)-6'-(hydroxymethyl)-3',4,5',6-tetrakis(oxidanyl)spiro[1H-2-benzofuran-3,2'-oxane]-4'-yl] (2E,4E,7S,8E,10E,14S)-8,14-dimethyl-7-oxidanyl-hexadeca-2,4,8,10-tetraenoate
MOLECULAR FORMULA: C31H42O10
MOLECULAR WEIGHT: 574.65918
SMILES: CC[C@H](C)CC/C=C/C=C(\C)/[C@H](C/C=C/C=C/C(=O)O[C@H]1[C@@H]([C@H](OC2([C@@H]1O)C3=C(C=C(C=C3CO2)O)O)CO)O)O
Structure:
CAS RN: 60827-69-2
CAS Name: (1R,4E,6R,7S,11Z)-4-ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione
OPENEYE Name: (1R,4E,6R,7S,11Z)-4-ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione
IUPAC Name: (1R,4E,6R,7S,11Z)-4-ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione
SYSTEMATIC NAME: (1R,4E,6R,7S,11Z)-4-ethylidene-6,7,14-trimethyl-7-oxidanyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione
MOLECULAR FORMULA: C19H27NO6
MOLECULAR WEIGHT: 365.42078
SMILES: C/C=C/1\C[C@H]([C@](C(=O)OC/C/2=C/CN(CC[C@H](C2=O)OC1=O)C)(C)O)C
Structure:
CAS RN: 60037-33-4
CAS Name: acetic acid [(2S,3S)-2,4-dimethoxy-6-oxo-2-[(E)-2-phenylethenyl]-3H-pyran-3-yl] ester
OPENEYE Name: [(2S,3S)-2,4-dimethoxy-6-oxo-2-[(E)-styryl]-3H-pyran-3-yl] acetate
IUPAC Name: [(2S,3S)-2,4-dimethoxy-6-oxo-2-[(E)-2-phenylethenyl]-3H-pyran-3-yl] acetate
SYSTEMATIC NAME: [(2S,3S)-2,4-dimethoxy-6-oxidanylidene-2-[(E)-2-phenylethenyl]-3H-pyran-3-yl] ethanoate
MOLECULAR FORMULA: C17H18O6
MOLECULAR WEIGHT: 318.32122
SMILES: CC(=O)O[C@H]1C(=CC(=O)O[C@]1(/C=C/C2=CC=CC=C2)OC)OC
Structure:
CAS RN: 60031-91-6
CAS Name: (2S)-2-[(2R,3E,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-hydroxypropanoic acid methyl ester
OPENEYE Name: methyl (2S)-2-[(2R,3E,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-hydroxy-propanoate
IUPAC Name: methyl (2S)-2-[(2R,3E,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-hydroxypropanoate
SYSTEMATIC NAME: methyl (2S)-2-[(2R,3E,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-oxidanyl-propanoate
MOLECULAR FORMULA: C21H26N2O3
MOLECULAR WEIGHT: 354.44274
SMILES: C/C=C\1/CN2CCC3=C([C@@H]2C[C@@H]1[C@@H](CO)C(=O)OC)NC4=CC=CC=C34
Structure:
CAS RN: 59808-33-2
CAS Name: (5E,8E,11E,14E)-20-hydroperoxyeicosa-5,8,11,14-tetraenoic acid
OPENEYE Name: (5E,8E,11E,14E)-20-hydroperoxyicosa-5,8,11,14-tetraenoic acid
IUPAC Name: (5E,8E,11E,14E)-20-hydroperoxyicosa-5,8,11,14-tetraenoic acid
SYSTEMATIC NAME: (5E,8E,11E,14E)-20-(dioxidanyl)icosa-5,8,11,14-tetraenoic acid
MOLECULAR FORMULA: C20H32O4
MOLECULAR WEIGHT: 336.46568
SMILES: C(CC/C=C/C/C=C/C/C=C/C/C=C/CCCC(=O)O)CCOO
Structure:
CAS RN: 59114-96-4
CAS Name: (E)-3-(3-bromophenyl)-2-propenamide
OPENEYE Name: (E)-3-(3-bromophenyl)prop-2-enamide
IUPAC Name: (E)-3-(3-bromophenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-3-(3-bromophenyl)prop-2-enamide
MOLECULAR FORMULA: C9H8BrNO
MOLECULAR WEIGHT: 226.06992
SMILES: C1=CC(=CC(=C1)Br)/C=C/C(=O)N
Structure:
CAS RN: 71539-43-0
CAS Name: (E)-3-(3-bromophenyl)-2-propenamide
OPENEYE Name: (E)-3-(3-bromophenyl)prop-2-enamide
IUPAC Name: (E)-3-(3-bromophenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-3-(3-bromophenyl)prop-2-enamide
MOLECULAR FORMULA: C9H8BrNO
MOLECULAR WEIGHT: 226.06992
SMILES: C1=CC(=CC(=C1)Br)/C=C/C(=O)N
Structure:
CAS RN: 58998-11-1
CAS Name: (3E,11Z)-trideca-1,3,11-trien-5,7,9-triyne
OPENEYE Name: (3E,11Z)-trideca-1,3,11-trien-5,7,9-triyne
IUPAC Name: (3E,11Z)-trideca-1,3,11-trien-5,7,9-triyne
SYSTEMATIC NAME: (3E,11Z)-trideca-1,3,11-trien-5,7,9-triyne
MOLECULAR FORMULA: C13H10
MOLECULAR WEIGHT: 166.2185
SMILES: C/C=C\C#CC#CC#C/C=C/C=C
Structure:
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