[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,3-dimethoxyphenyl)-2-propenoic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(2,3-dimethoxyphenyl)acrylic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C20H20O5S MolecularWeight: 372.4348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=CC(=O)OCC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=C/C(=O)OCC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C20H20O5S/c1-23-18-6-4-5-15(20(18)24-2)9-12-19(22)25-13-17(21)14-7-10-16(26-3)11-8-14/h4-12H,13H2,1-3H3/b12-9+