O-methyl 7-(3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)-2-phenyl-heptanethioate

Systemtic Name: O-methyl 7-(3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)-2-phenyl-heptanethioate Openeye Name: O-methyl 7-(3-hydroxy-5-oxo-cyclopenten-1-yl)-2-phenyl-heptanethioate CAS Name: 7-(3-hydroxy-5-oxo-1-cyclopentenyl)-2-phenylheptanethioic acid O-methyl ester IUPAC Name: O-methyl 7-(3-hydroxy-5-oxocyclopenten-1-yl)-2-phenylheptanethioate Traditional Name: 7-(3-hydroxy-5-keto-cyclopenten-1-yl)-2-phenyl-heptanethioic acid O-methyl ester Formula: C19H24O3S MolecularWeight: 332.45706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=S)C(CCCCCC1=CC(CC1=O)O)C2=CC=CC=C2

Isomeric SMILES

COC(=S)C(CCCCCC1=CC(CC1=O)O)C2=CC=CC=C2

InChI

InChI=1S/C19H24O3S/c1-22-19(23)17(14-8-4-2-5-9-14)11-7-3-6-10-15-12-16(20)13-18(15)21/h2,4-5,8-9,12,16-17,20H,3,6-7,10-11,13H2,1H3