methyl (Z)-3-(4-methylphenyl)-2-(sulfanylmethyl)prop-2-enoate

Systemtic Name: methyl (Z)-3-(4-methylphenyl)-2-(sulfanylmethyl)prop-2-enoate Openeye Name: methyl (Z)-3-(p-tolyl)-2-(sulfanylmethyl)prop-2-enoate CAS Name: (Z)-2-(mercaptomethyl)-3-(4-methylphenyl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-(4-methylphenyl)-2-(sulfanylmethyl)prop-2-enoate Traditional Name: (Z)-2-(mercaptomethyl)-3-(p-tolyl)acrylic acid methyl ester Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(CS)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\CS)/C(=O)OC

InChI

InChI=1S/C12H14O2S/c1-9-3-5-10(6-4-9)7-11(8-15)12(13)14-2/h3-7,15H,8H2,1-2H3/b11-7+