methyl 3-oxidanylidene-2,2-bis(phenylsulfanyl)butanoate

Systemtic Name: methyl 3-oxidanylidene-2,2-bis(phenylsulfanyl)butanoate Openeye Name: methyl 3-oxo-2,2-bis(phenylsulfanyl)butanoate CAS Name: 3-oxo-2,2-bis(phenylthio)butanoic acid methyl ester IUPAC Name: methyl 3-oxo-2,2-bis(phenylsulfanyl)butanoate Traditional Name: 3-keto-2,2-bis(phenylthio)butyric acid methyl ester Formula: C17H16O3S2 MolecularWeight: 332.43714

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)OC)(SC1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

CC(=O)C(C(=O)OC)(SC1=CC=CC=C1)SC2=CC=CC=C2

InChI

InChI=1S/C17H16O3S2/c1-13(18)17(16(19)20-2,21-14-9-5-3-6-10-14)22-15-11-7-4-8-12-15/h3-12H,1-2H3