methyl (E)-2-methyl-5-phenylsulfanyl-pent-2-enoate

Systemtic Name: methyl (E)-2-methyl-5-phenylsulfanyl-pent-2-enoate Openeye Name: methyl (E)-2-methyl-5-phenylsulfanyl-pent-2-enoate CAS Name: (E)-2-methyl-5-(phenylthio)-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-2-methyl-5-phenylsulfanylpent-2-enoate Traditional Name: (E)-2-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(=CCCSC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

C/C(=C\CCSC1=CC=CC=C1)/C(=O)OC

InChI

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