methyl (Z,4S)-4-methyl-5-phenylsulfanyl-pent-2-enoate

Systemtic Name: methyl (Z,4S)-4-methyl-5-phenylsulfanyl-pent-2-enoate Openeye Name: methyl (Z,4S)-4-methyl-5-phenylsulfanyl-pent-2-enoate CAS Name: (Z,4S)-4-methyl-5-(phenylthio)-2-pentenoic acid methyl ester IUPAC Name: methyl (Z,4S)-4-methyl-5-phenylsulfanylpent-2-enoate Traditional Name: (Z,4S)-4-methyl-5-(phenylthio)pent-2-enoic acid methyl ester Formula: C13H16O2S MolecularWeight: 236.32994

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC=CC=C1)C=CC(=O)OC

Isomeric SMILES

C[C@H](CSC1=CC=CC=C1)/C=C\C(=O)OC

InChI

InChI=1S/C13H16O2S/c1-11(8-9-13(14)15-2)10-16-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3/b9-8-/t11-/m0/s1