methyl (E)-2-[(4-methylsulfanylphenyl)-oxidanyl-methyl]but-2-enoate

Systemtic Name: methyl (E)-2-[(4-methylsulfanylphenyl)-oxidanyl-methyl]but-2-enoate Openeye Name: methyl (E)-2-[hydroxy-(4-methylsulfanylphenyl)methyl]but-2-enoate CAS Name: (E)-2-[hydroxy-[4-(methylthio)phenyl]methyl]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-2-[hydroxy-(4-methylsulfanylphenyl)methyl]but-2-enoate Traditional Name: (E)-2-[hydroxy-[4-(methylthio)phenyl]methyl]but-2-enoic acid methyl ester Formula: C13H16O3S MolecularWeight: 252.32934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O3S/c1-4-11(13(15)16-2)12(14)9-5-7-10(17-3)8-6-9/h4-8,12,14H,1-3H3/b11-4+