methyl (E)-3-(4-methylphenyl)sulfinyl-6-phenyl-hex-2-enoate

Systemtic Name: methyl (E)-3-(4-methylphenyl)sulfinyl-6-phenyl-hex-2-enoate Openeye Name: methyl (E)-6-phenyl-3-(p-tolylsulfinyl)hex-2-enoate CAS Name: (E)-3-(4-methylphenyl)sulfinyl-6-phenyl-2-hexenoic acid methyl ester IUPAC Name: methyl (E)-3-(4-methylphenyl)sulfinyl-6-phenylhex-2-enoate Traditional Name: (E)-6-phenyl-3-(p-tolylsulfinyl)hex-2-enoic acid methyl ester Formula: C20H22O3S MolecularWeight: 342.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C(=CC(=O)OC)CCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)/C(=C/C(=O)OC)/CCCC2=CC=CC=C2

InChI

InChI=1S/C20H22O3S/c1-16-11-13-18(14-12-16)24(22)19(15-20(21)23-2)10-6-9-17-7-4-3-5-8-17/h3-5,7-8,11-15H,6,9-10H2,1-2H3/b19-15+