[3-(3,4-dimethoxyphenyl)-4,4-bis(methylsulfanyl)-5-oxidanylidene-cyclopenten-1-yl] ethanoate

Systemtic Name: [3-(3,4-dimethoxyphenyl)-4,4-bis(methylsulfanyl)-5-oxidanylidene-cyclopenten-1-yl] ethanoate Openeye Name: [3-(3,4-dimethoxyphenyl)-4,4-bis(methylsulfanyl)-5-oxo-cyclopenten-1-yl] acetate CAS Name: acetic acid [3-(3,4-dimethoxyphenyl)-4,4-bis(methylthio)-5-oxo-1-cyclopentenyl] ester IUPAC Name: [3-(3,4-dimethoxyphenyl)-4,4-bis(methylsulfanyl)-5-oxocyclopenten-1-yl] acetate Traditional Name: acetic acid [3-(3,4-dimethoxyphenyl)-5-keto-4,4-bis(methylthio)cyclopenten-1-yl] ester Formula: C17H20O5S2 MolecularWeight: 368.4677

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(C(C1=O)(SC)SC)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=O)OC1=CC(C(C1=O)(SC)SC)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H20O5S2/c1-10(18)22-15-9-12(17(23-4,24-5)16(15)19)11-6-7-13(20-2)14(8-11)21-3/h6-9,12H,1-5H3