CAS RN: 24909-72-6
CAS Name: (Z)-9-octadecenoic acid [(Z)-1-oxooctadec-9-enyl] ester
OPENEYE Name: [(Z)-octadec-9-enoyl] (Z)-octadec-9-enoate
IUPAC Name: [(Z)-octadec-9-enoyl] (Z)-octadec-9-enoate
SYSTEMATIC NAME: [(Z)-octadec-9-enoyl] (Z)-octadec-9-enoate
MOLECULAR FORMULA: C36H66O3
MOLECULAR WEIGHT: 546.90744
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)OC(=O)CCCCCCC/C=C\CCCCCCCC
Structure:
CAS RN: 112-21-0
CAS Name: (E)-N,N'-diethyl-2-butene-1,4-diamine
OPENEYE Name: (E)-N,N'-diethylbut-2-ene-1,4-diamine
IUPAC Name: (E)-N,N'-diethylbut-2-ene-1,4-diamine
SYSTEMATIC NAME: (E)-N,N'-diethylbut-2-ene-1,4-diamine
MOLECULAR FORMULA: C8H18N2
MOLECULAR WEIGHT: 142.24192
SMILES: CCNC/C=C/CNCC
Structure:
CAS RN: 23028-85-5
CAS Name: (E)-N,N'-diethyl-2-butene-1,4-diamine
OPENEYE Name: (E)-N,N'-diethylbut-2-ene-1,4-diamine
IUPAC Name: (E)-N,N'-diethylbut-2-ene-1,4-diamine
SYSTEMATIC NAME: (E)-N,N'-diethylbut-2-ene-1,4-diamine
MOLECULAR FORMULA: C8H18N2
MOLECULAR WEIGHT: 142.24192
SMILES: CCNC/C=C/CNCC
Structure:
CAS RN: 7367-78-4
CAS Name: (2E,4E)-hexa-2,4-dienoic acid butyl ester
OPENEYE Name: butyl (2E,4E)-hexa-2,4-dienoate
IUPAC Name: butyl (2E,4E)-hexa-2,4-dienoate
SYSTEMATIC NAME: butyl (2E,4E)-hexa-2,4-dienoate
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: CCCCOC(=O)/C=C/C=C/C
Structure:
CAS RN: 39761-64-3
CAS Name: (Z)-3,4,4-trimethyl-2-pentene
OPENEYE Name: (Z)-3,4,4-trimethylpent-2-ene
IUPAC Name: (Z)-3,4,4-trimethylpent-2-ene
SYSTEMATIC NAME: (Z)-3,4,4-trimethylpent-2-ene
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: C/C=C(/C)\C(C)(C)C
Structure:
CAS RN: 27310-22-1
CAS Name: (2E,4E)-1,1-diethoxyhexa-2,4-diene
OPENEYE Name: (2E,4E)-1,1-diethoxyhexa-2,4-diene
IUPAC Name: (2E,4E)-1,1-diethoxyhexa-2,4-diene
SYSTEMATIC NAME: (2E,4E)-1,1-diethoxyhexa-2,4-diene
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCOC(/C=C/C=C/C)OCC
Structure:
CAS RN: 94088-28-5
CAS Name: (2E,4E)-1,1-diethoxyhexa-2,4-diene
OPENEYE Name: (2E,4E)-1,1-diethoxyhexa-2,4-diene
IUPAC Name: (2E,4E)-1,1-diethoxyhexa-2,4-diene
SYSTEMATIC NAME: (2E,4E)-1,1-diethoxyhexa-2,4-diene
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCOC(/C=C/C=C/C)OCC
Structure:
CAS RN: 2417-88-1
CAS Name: (2E,4Z)-3,4-dimethylhexa-2,4-diene
OPENEYE Name: (2E,4Z)-3,4-dimethylhexa-2,4-diene
IUPAC Name: (2E,4Z)-3,4-dimethylhexa-2,4-diene
SYSTEMATIC NAME: (2E,4Z)-3,4-dimethylhexa-2,4-diene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: C/C=C(\C)/C(=C\C)/C
Structure:
CAS RN: 44987-75-9
CAS Name: (2E,4E)-hexa-2,4-dienoic acid propan-2-yl ester
OPENEYE Name: isopropyl (2E,4E)-hexa-2,4-dienoate
IUPAC Name: propan-2-yl (2E,4E)-hexa-2,4-dienoate
SYSTEMATIC NAME: propan-2-yl (2E,4E)-hexa-2,4-dienoate
MOLECULAR FORMULA: C9H14O2
MOLECULAR WEIGHT: 154.20626
SMILES: C/C=C/C=C/C(=O)OC(C)C
Structure:
CAS RN: 30651-70-8
CAS Name: (3E,5E)-4,5-diethylocta-3,5-diene
OPENEYE Name: (3E,5E)-4,5-diethylocta-3,5-diene
IUPAC Name: (3E,5E)-4,5-diethylocta-3,5-diene
SYSTEMATIC NAME: (3E,5E)-4,5-diethylocta-3,5-diene
MOLECULAR FORMULA: C12H22
MOLECULAR WEIGHT: 166.30308
SMILES: CC/C=C(/C(=C/CC)/CC)\CC
Structure:
CAS RN: 59681-35-5
CAS Name: (4E)-2,3-dimethylhexa-2,4-diene
OPENEYE Name: (4E)-2,3-dimethylhexa-2,4-diene
IUPAC Name: (4E)-2,3-dimethylhexa-2,4-diene
SYSTEMATIC NAME: (4E)-2,3-dimethylhexa-2,4-diene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: C/C=C/C(=C(C)C)C
Structure:
CAS RN: 36320-14-6
CAS Name: (3E)-5,5-dimethylhexa-1,3-diene
OPENEYE Name: (3E)-5,5-dimethylhexa-1,3-diene
IUPAC Name: (3E)-5,5-dimethylhexa-1,3-diene
SYSTEMATIC NAME: (3E)-5,5-dimethylhexa-1,3-diene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: CC(C)(C)/C=C/C=C
Structure:
CAS RN: 59697-92-6
CAS Name: (3E)-5,5-dimethylhexa-1,3-diene
OPENEYE Name: (3E)-5,5-dimethylhexa-1,3-diene
IUPAC Name: (3E)-5,5-dimethylhexa-1,3-diene
SYSTEMATIC NAME: (3E)-5,5-dimethylhexa-1,3-diene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: CC(C)(C)/C=C/C=C
Structure:
CAS RN: 10297-72-0
CAS Name: (2E,4E)-hexa-2,4-dienoic acid propyl ester
OPENEYE Name: propyl (2E,4E)-hexa-2,4-dienoate
IUPAC Name: propyl (2E,4E)-hexa-2,4-dienoate
SYSTEMATIC NAME: propyl (2E,4E)-hexa-2,4-dienoate
MOLECULAR FORMULA: C9H14O2
MOLECULAR WEIGHT: 154.20626
SMILES: CCCOC(=O)/C=C/C=C/C
Structure:
CAS RN: 81280-12-8
CAS Name: (E)-4-methyl-4-hepten-3-ol
OPENEYE Name: (E)-4-methylhept-4-en-3-ol
IUPAC Name: (E)-4-methylhept-4-en-3-ol
SYSTEMATIC NAME: (E)-4-methylhept-4-en-3-ol
MOLECULAR FORMULA: C8H16O
MOLECULAR WEIGHT: 128.21204
SMILES: CC/C=C(\C)/C(CC)O
Structure:
CAS RN: 17603-57-5
CAS Name: (3E)-4-methylhepta-1,3-diene
OPENEYE Name: (3E)-4-methylhepta-1,3-diene
IUPAC Name: (3E)-4-methylhepta-1,3-diene
SYSTEMATIC NAME: (3E)-4-methylhepta-1,3-diene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: CCC/C(=C/C=C)/C
Structure:
CAS RN: 40095-05-4
CAS Name: (3E)-4-methylhepta-1,3-diene
OPENEYE Name: (3E)-4-methylhepta-1,3-diene
IUPAC Name: (3E)-4-methylhepta-1,3-diene
SYSTEMATIC NAME: (3E)-4-methylhepta-1,3-diene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: CCC/C(=C/C=C)/C
Structure:
CAS RN: 3588-18-9
CAS Name: (5E)-2,6-dimethyl-4-octa-5,7-dienone
OPENEYE Name: (5E)-2,6-dimethylocta-5,7-dien-4-one
IUPAC Name: (5E)-2,6-dimethylocta-5,7-dien-4-one
SYSTEMATIC NAME: (5E)-2,6-dimethylocta-5,7-dien-4-one
MOLECULAR FORMULA: C10H16O
MOLECULAR WEIGHT: 152.23344
SMILES: CC(C)CC(=O)/C=C(\C)/C=C
Structure:
CAS RN: 6752-80-3
CAS Name: (5E)-2,6-dimethyl-4-octa-5,7-dienone
OPENEYE Name: (5E)-2,6-dimethylocta-5,7-dien-4-one
IUPAC Name: (5E)-2,6-dimethylocta-5,7-dien-4-one
SYSTEMATIC NAME: (5E)-2,6-dimethylocta-5,7-dien-4-one
MOLECULAR FORMULA: C10H16O
MOLECULAR WEIGHT: 152.23344
SMILES: CC(C)CC(=O)/C=C(\C)/C=C
Structure:
CAS RN: 18669-52-8
CAS Name: (4E)-2,3-dimethylhexa-1,4-diene
OPENEYE Name: (4E)-2,3-dimethylhexa-1,4-diene
IUPAC Name: (4E)-2,3-dimethylhexa-1,4-diene
SYSTEMATIC NAME: (4E)-2,3-dimethylhexa-1,4-diene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: C/C=C/C(C)C(=C)C
Structure:
CAS RN: 35663-85-5
CAS Name: (E)-3-(3,4-dihydro-2H-pyrrol-5-yl)-2-propenamide
OPENEYE Name: (E)-3-(3,4-dihydro-2H-pyrrol-5-yl)prop-2-enamide
IUPAC Name: (E)-3-(3,4-dihydro-2H-pyrrol-5-yl)prop-2-enamide
SYSTEMATIC NAME: (E)-3-(3,4-dihydro-2H-pyrrol-5-yl)prop-2-enamide
MOLECULAR FORMULA: C7H10N2O
MOLECULAR WEIGHT: 138.1671
SMILES: C1CC(=NC1)/C=C/C(=O)N
Structure:
CAS RN: 43043-82-9
CAS Name: (E)-3-(3,4-dihydro-2H-pyrrol-5-yl)-2-propenamide
OPENEYE Name: (E)-3-(3,4-dihydro-2H-pyrrol-5-yl)prop-2-enamide
IUPAC Name: (E)-3-(3,4-dihydro-2H-pyrrol-5-yl)prop-2-enamide
SYSTEMATIC NAME: (E)-3-(3,4-dihydro-2H-pyrrol-5-yl)prop-2-enamide
MOLECULAR FORMULA: C7H10N2O
MOLECULAR WEIGHT: 138.1671
SMILES: C1CC(=NC1)/C=C/C(=O)N
Structure:
CAS RN: 5205-32-3
CAS Name: (2E,4E,6E)-octa-2,4,6-trienoic acid
OPENEYE Name: (2E,4E,6E)-octa-2,4,6-trienoic acid
IUPAC Name: (2E,4E,6E)-octa-2,4,6-trienoic acid
SYSTEMATIC NAME: (2E,4E,6E)-octa-2,4,6-trienoic acid
MOLECULAR FORMULA: C8H10O2
MOLECULAR WEIGHT: 138.1638
SMILES: C/C=C/C=C/C=C/C(=O)O
Structure:
CAS RN: 673-84-7
CAS Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
OPENEYE Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
IUPAC Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
SYSTEMATIC NAME: (4E,6E)-2,6-dimethylocta-2,4,6-triene
MOLECULAR FORMULA: C10H16
MOLECULAR WEIGHT: 136.23404
SMILES: C/C=C(\C)/C=C/C=C(C)C
Structure:
CAS RN: 3016-19-1
CAS Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
OPENEYE Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
IUPAC Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
SYSTEMATIC NAME: (4E,6E)-2,6-dimethylocta-2,4,6-triene
MOLECULAR FORMULA: C10H16
MOLECULAR WEIGHT: 136.23404
SMILES: C/C=C(\C)/C=C/C=C(C)C
Structure:
CAS RN: 17627-38-2
CAS Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
OPENEYE Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
IUPAC Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
SYSTEMATIC NAME: (4E,6E)-2,6-dimethylocta-2,4,6-triene
MOLECULAR FORMULA: C10H16
MOLECULAR WEIGHT: 136.23404
SMILES: C/C=C(\C)/C=C/C=C(C)C
Structure:
CAS RN: 17627-39-3
CAS Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
OPENEYE Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
IUPAC Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
SYSTEMATIC NAME: (4E,6E)-2,6-dimethylocta-2,4,6-triene
MOLECULAR FORMULA: C10H16
MOLECULAR WEIGHT: 136.23404
SMILES: C/C=C(\C)/C=C/C=C(C)C
Structure:
CAS RN: 23487-64-1
CAS Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
OPENEYE Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
IUPAC Name: (4E,6E)-2,6-dimethylocta-2,4,6-triene
SYSTEMATIC NAME: (4E,6E)-2,6-dimethylocta-2,4,6-triene
MOLECULAR FORMULA: C10H16
MOLECULAR WEIGHT: 136.23404
SMILES: C/C=C(\C)/C=C/C=C(C)C
Structure:
CAS RN: 5986-38-9
CAS Name: (5E)-2,6-dimethyl-2-octa-5,7-dienol
OPENEYE Name: (5E)-2,6-dimethylocta-5,7-dien-2-ol
IUPAC Name: (5E)-2,6-dimethylocta-5,7-dien-2-ol
SYSTEMATIC NAME: (5E)-2,6-dimethylocta-5,7-dien-2-ol
MOLECULAR FORMULA: C10H18O
MOLECULAR WEIGHT: 154.24932
SMILES: C/C(=C\CCC(C)(C)O)/C=C
Structure:
CAS RN: 15192-80-0
CAS Name: (2E,4E,6E)-octa-2,4,6-triene
OPENEYE Name: (2E,4E,6E)-octa-2,4,6-triene
IUPAC Name: (2E,4E,6E)-octa-2,4,6-triene
SYSTEMATIC NAME: (2E,4E,6E)-octa-2,4,6-triene
MOLECULAR FORMULA: C8H12
MOLECULAR WEIGHT: 108.18088
SMILES: C/C=C/C=C/C=C/C
Structure:
CAS RN: 1733-40-0
CAS Name: (E)-N-phenyl-2-butenamide
OPENEYE Name: (E)-N-phenylbut-2-enamide
IUPAC Name: (E)-N-phenylbut-2-enamide
SYSTEMATIC NAME: (E)-N-phenylbut-2-enamide
MOLECULAR FORMULA: C10H11NO
MOLECULAR WEIGHT: 161.20044
SMILES: C/C=C/C(=O)NC1=CC=CC=C1
Structure:
CAS RN: 14044-81-6
CAS Name: 1-cyano-N'-(2-hydroxyanilino)-N-[(Z)-(6-oxo-1-cyclohexa-2,4-dienylidene)amino]methanimidamide
OPENEYE Name: 1-cyano-N'-(2-hydroxyanilino)-N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)amino]formamidine
IUPAC Name: 1-cyano-N'-(2-hydroxyanilino)-N-[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)amino]methanimidamide
SYSTEMATIC NAME: 1-cyano-N'-[(2-hydroxyphenyl)amino]-N-[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)amino]methanimidamide
MOLECULAR FORMULA: C14H11N5O2
MOLECULAR WEIGHT: 281.26944
SMILES: C1=CC=C(C(=C1)N/N=C(\C#N)/N/N=C\2/C=CC=CC2=O)O
Structure:
CAS RN: 515-57-1
CAS Name: (E)-4-oxo-4-[4-(2-thiazolylsulfamoyl)anilino]-2-butenoic acid
OPENEYE Name: (E)-4-oxo-4-[4-(thiazol-2-ylsulfamoyl)anilino]but-2-enoic acid
IUPAC Name: (E)-4-oxo-4-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]but-2-enoic acid
SYSTEMATIC NAME: (E)-4-oxidanylidene-4-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]amino]but-2-enoic acid
MOLECULAR FORMULA: C13H11N3O5S2
MOLECULAR WEIGHT: 353.37354
SMILES: C1=CC(=CC=C1NC(=O)/C=C/C(=O)O)S(=O)(=O)NC2=NC=CS2
Structure:
CAS RN: 3156-39-6
CAS Name: 1-nitro-2-[(E)-2-nitroethenyl]benzene
OPENEYE Name: 1-nitro-2-[(E)-2-nitrovinyl]benzene
IUPAC Name: 1-nitro-2-[(E)-2-nitroethenyl]benzene
SYSTEMATIC NAME: 1-nitro-2-[(E)-2-nitroethenyl]benzene
MOLECULAR FORMULA: C8H6N2O4
MOLECULAR WEIGHT: 194.14424
SMILES: C1=CC=C(C(=C1)/C=C/[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 224313-91-1
CAS Name: (E)-3-[(phenylmethyl)amino]-2-butenoic acid ethyl ester
OPENEYE Name: ethyl (E)-3-(benzylamino)but-2-enoate
IUPAC Name: ethyl (E)-3-(benzylamino)but-2-enoate
SYSTEMATIC NAME: ethyl (E)-3-[(phenylmethyl)amino]but-2-enoate
MOLECULAR FORMULA: C13H17NO2
MOLECULAR WEIGHT: 219.27958
SMILES: CCOC(=O)/C=C(\C)/NCC1=CC=CC=C1
Structure:
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