methyl (E)-4-methyl-2-(phenylsulfanylmethyl)pent-2-enoate

Systemtic Name: methyl (E)-4-methyl-2-(phenylsulfanylmethyl)pent-2-enoate Openeye Name: methyl (E)-4-methyl-2-(phenylsulfanylmethyl)pent-2-enoate CAS Name: (E)-4-methyl-2-[(phenylthio)methyl]-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-4-methyl-2-(phenylsulfanylmethyl)pent-2-enoate Traditional Name: (E)-4-methyl-2-[(phenylthio)methyl]pent-2-enoic acid methyl ester Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O2S/c1-11(2)9-12(14(15)16-3)10-17-13-7-5-4-6-8-13/h4-9,11H,10H2,1-3H3/b12-9-