dimethyl (2E)-2-[(phenylmethylsulfanyl)methylidene]butanedioate

Systemtic Name: dimethyl (2E)-2-[(phenylmethylsulfanyl)methylidene]butanedioate Openeye Name: dimethyl (2E)-2-(benzylsulfanylmethylene)butanedioate CAS Name: (2E)-2-[(phenylmethylthio)methylidene]butanedioic acid dimethyl ester IUPAC Name: dimethyl (2E)-2-(benzylsulfanylmethylidene)butanedioate Traditional Name: (2E)-2-[(benzylthio)methylene]succinic acid dimethyl ester Formula: C14H16O4S MolecularWeight: 280.33944

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=CSCC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

COC(=O)C/C(=C\SCC1=CC=CC=C1)/C(=O)OC

InChI

InChI=1S/C14H16O4S/c1-17-13(15)8-12(14(16)18-2)10-19-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3/b12-10+