[(E,7Z)-4-acetyloxy-7-[4-methylsulfanyl-2-oxidanyl-5-oxidanylidene-2-(4-phenoxybutyl)cyclopent-3-en-1-ylidene]hept-5-enyl] ethanoate

Systemtic Name: [(E,7Z)-4-acetyloxy-7-[4-methylsulfanyl-2-oxidanyl-5-oxidanylidene-2-(4-phenoxybutyl)cyclopent-3-en-1-ylidene]hept-5-enyl] ethanoate Openeye Name: [(E,7Z)-4-acetoxy-7-[2-hydroxy-4-methylsulfanyl-5-oxo-2-(4-phenoxybutyl)cyclopent-3-en-1-ylidene]hept-5-enyl] acetate CAS Name: acetic acid [(E,7Z)-4-acetyloxy-7-[2-hydroxy-4-(methylthio)-5-oxo-2-(4-phenoxybutyl)-1-cyclopent-3-enylidene]hept-5-enyl] ester IUPAC Name: [(E,7Z)-4-acetyloxy-7-[2-hydroxy-4-methylsulfanyl-5-oxo-2-(4-phenoxybutyl)cyclopent-3-en-1-ylidene]hept-5-enyl] acetate Traditional Name: acetic acid [(E,7Z)-4-acetoxy-7-[2-hydroxy-5-keto-4-(methylthio)-2-(4-phenoxybutyl)cyclopent-3-en-1-ylidene]hept-5-enyl] ester Formula: C27H34O7S MolecularWeight: 502.61966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCC(C=CC=C1C(=O)C(=CC1(CCCCOC2=CC=CC=C2)O)SC)OC(=O)C

Isomeric SMILES

CC(=O)OCCCC(/C=C/C=C/1\C(=O)C(=CC1(CCCCOC2=CC=CC=C2)O)SC)OC(=O)C

InChI

InChI=1S/C27H34O7S/c1-20(28)32-18-10-14-23(34-21(2)29)13-9-15-24-26(30)25(35-3)19-27(24,31)16-7-8-17-33-22-11-5-4-6-12-22/h4-6,9,11-13,15,19,23,31H,7-8,10,14,16-18H2,1-3H3/b13-9+,24-15+