methyl (E)-3-[3-methoxy-4-[2-(2-methylphenyl)sulfanylethanoyloxy]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-methoxy-4-[2-(2-methylphenyl)sulfanylethanoyloxy]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[3-methoxy-4-[2-(o-tolylsulfanyl)acetyl]oxy-phenyl]prop-2-enoate CAS Name: (E)-3-[3-methoxy-4-[2-[(2-methylphenyl)thio]-1-oxoethoxy]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-methoxy-4-[2-(2-methylphenyl)sulfanylacetyl]oxyphenyl]prop-2-enoate Traditional Name: (E)-3-[3-methoxy-4-[2-(o-tolylthio)acetyl]oxy-phenyl]acrylic acid methyl ester Formula: C20H20O5S MolecularWeight: 372.4348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OC2=C(C=C(C=C2)C=CC(=O)OC)OC

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OC2=C(C=C(C=C2)/C=C/C(=O)OC)OC

InChI

InChI=1S/C20H20O5S/c1-14-6-4-5-7-18(14)26-13-20(22)25-16-10-8-15(12-17(16)23-2)9-11-19(21)24-3/h4-12H,13H2,1-3H3/b11-9+