[3,5-dimethoxy-2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl] propanoate

Systemtic Name: [3,5-dimethoxy-2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl] propanoate Openeye Name: [3,5-dimethoxy-2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl] propanoate CAS Name: propanoic acid [3,5-dimethoxy-2-[(E)-3-[4-(methylthio)phenyl]-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [3,5-dimethoxy-2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl] propanoate Traditional Name: propionic acid [3,5-dimethoxy-2-[(E)-3-[4-(methylthio)phenyl]acryloyl]phenyl] ester Formula: C21H22O5S MolecularWeight: 386.46138

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C(=CC(=C1)OC)OC)C(=O)C=CC2=CC=C(C=C2)SC

Isomeric SMILES

CCC(=O)OC1=C(C(=CC(=C1)OC)OC)C(=O)/C=C/C2=CC=C(C=C2)SC

InChI

InChI=1S/C21H22O5S/c1-5-20(23)26-19-13-15(24-2)12-18(25-3)21(19)17(22)11-8-14-6-9-16(27-4)10-7-14/h6-13H,5H2,1-4H3/b11-8+