methyl (E)-4-phenyl-3-phenylsulfanyl-but-2-enoate

Systemtic Name: methyl (E)-4-phenyl-3-phenylsulfanyl-but-2-enoate Openeye Name: methyl (E)-4-phenyl-3-phenylsulfanyl-but-2-enoate CAS Name: (E)-4-phenyl-3-(phenylthio)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-phenyl-3-phenylsulfanylbut-2-enoate Traditional Name: (E)-4-phenyl-3-(phenylthio)but-2-enoic acid methyl ester Formula: C17H16O2S MolecularWeight: 284.37274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(CC1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

COC(=O)/C=C(\CC1=CC=CC=C1)/SC2=CC=CC=C2

InChI

InChI=1S/C17H16O2S/c1-19-17(18)13-16(12-14-8-4-2-5-9-14)20-15-10-6-3-7-11-15/h2-11,13H,12H2,1H3/b16-13+