methyl 2-(3-oxidanylidenecyclopentyl)-2-phenylsulfanyl-ethanoate

Systemtic Name: methyl 2-(3-oxidanylidenecyclopentyl)-2-phenylsulfanyl-ethanoate Openeye Name: methyl 2-(3-oxocyclopentyl)-2-phenylsulfanyl-acetate CAS Name: 2-(3-oxocyclopentyl)-2-(phenylthio)acetic acid methyl ester IUPAC Name: methyl 2-(3-oxocyclopentyl)-2-phenylsulfanylacetate Traditional Name: 2-(3-ketocyclopentyl)-2-(phenylthio)acetic acid methyl ester Formula: C14H16O3S MolecularWeight: 264.34004

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCC(=O)C1)SC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(C1CCC(=O)C1)SC2=CC=CC=C2

InChI

InChI=1S/C14H16O3S/c1-17-14(16)13(10-7-8-11(15)9-10)18-12-5-3-2-4-6-12/h2-6,10,13H,7-9H2,1H3