methyl (E)-3-(4-methylphenyl)sulfinyl-5-phenylmethoxy-pent-2-enoate

Systemtic Name: methyl (E)-3-(4-methylphenyl)sulfinyl-5-phenylmethoxy-pent-2-enoate Openeye Name: methyl (E)-5-benzyloxy-3-(p-tolylsulfinyl)pent-2-enoate CAS Name: (E)-3-(4-methylphenyl)sulfinyl-5-phenylmethoxy-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-3-(4-methylphenyl)sulfinyl-5-phenylmethoxypent-2-enoate Traditional Name: (E)-5-benzoxy-3-(p-tolylsulfinyl)pent-2-enoic acid methyl ester Formula: C20H22O4S MolecularWeight: 358.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C(=CC(=O)OC)CCOCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)/C(=C/C(=O)OC)/CCOCC2=CC=CC=C2

InChI

InChI=1S/C20H22O4S/c1-16-8-10-18(11-9-16)25(22)19(14-20(21)23-2)12-13-24-15-17-6-4-3-5-7-17/h3-11,14H,12-13,15H2,1-2H3/b19-14+