(Z)-4-methyl-2-(phenylsulfanylmethyl)pent-2-enoic acid

Systemtic Name: (Z)-4-methyl-2-(phenylsulfanylmethyl)pent-2-enoic acid Openeye Name: (Z)-4-methyl-2-(phenylsulfanylmethyl)pent-2-enoic acid CAS Name: (Z)-4-methyl-2-[(phenylthio)methyl]-2-pentenoic acid IUPAC Name: (Z)-4-methyl-2-(phenylsulfanylmethyl)pent-2-enoic acid Traditional Name: (Z)-4-methyl-2-[(phenylthio)methyl]pent-2-enoic acid Formula: C13H16O2S MolecularWeight: 236.32994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)/C=C(\CSC1=CC=CC=C1)/C(=O)O

InChI

InChI=1S/C13H16O2S/c1-10(2)8-11(13(14)15)9-16-12-6-4-3-5-7-12/h3-8,10H,9H2,1-2H3,(H,14,15)/b11-8+