methyl (Z)-4-acetyloxy-2-oxidanylidene-3-phenylsulfanyl-but-3-enoate

Systemtic Name: methyl (Z)-4-acetyloxy-2-oxidanylidene-3-phenylsulfanyl-but-3-enoate Openeye Name: methyl (Z)-4-acetoxy-2-oxo-3-phenylsulfanyl-but-3-enoate CAS Name: (Z)-4-acetyloxy-2-oxo-3-(phenylthio)-3-butenoic acid methyl ester IUPAC Name: methyl (Z)-4-acetyloxy-2-oxo-3-phenylsulfanylbut-3-enoate Traditional Name: (Z)-4-acetoxy-2-keto-3-(phenylthio)but-3-enoic acid methyl ester Formula: C13H12O5S MolecularWeight: 280.29638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)O/C=C(/C(=O)C(=O)OC)\SC1=CC=CC=C1

InChI

InChI=1S/C13H12O5S/c1-9(14)18-8-11(12(15)13(16)17-2)19-10-6-4-3-5-7-10/h3-8H,1-2H3/b11-8-