2-[[2-methoxy-5-[(E)-3-(2-methylphenyl)prop-2-enoyl]phenyl]methylsulfanyl]ethanoate

Systemtic Name: 2-[[2-methoxy-5-[(E)-3-(2-methylphenyl)prop-2-enoyl]phenyl]methylsulfanyl]ethanoate Openeye Name: 2-[[2-methoxy-5-[(E)-3-(o-tolyl)prop-2-enoyl]phenyl]methylsulfanyl]acetate CAS Name: 2-[[2-methoxy-5-[(E)-3-(2-methylphenyl)-1-oxoprop-2-enyl]phenyl]methylthio]acetate IUPAC Name: 2-[[2-methoxy-5-[(E)-3-(2-methylphenyl)prop-2-enoyl]phenyl]methylsulfanyl]acetate Traditional Name: 2-[[2-methoxy-5-[(E)-3-(o-tolyl)acryloyl]benzyl]thio]acetate Formula: C20H19O4S- MolecularWeight: 355.42746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC(=O)C2=CC(=C(C=C2)OC)CSCC(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1/C=C/C(=O)C2=CC(=C(C=C2)OC)CSCC(=O)[O-]

InChI

InChI=1S/C20H20O4S/c1-14-5-3-4-6-15(14)7-9-18(21)16-8-10-19(24-2)17(11-16)12-25-13-20(22)23/h3-11H,12-13H2,1-2H3,(H,22,23)/p-1/b9-7+