[(E)-3-(4-chlorophenyl)-2,3-diphenyl-prop-2-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-3-(4-chlorophenyl)-2,3-diphenyl-prop-2-enyl] 4-methylbenzenesulfonate Openeye Name: [(E)-3-(4-chlorophenyl)-2,3-diphenyl-allyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-3-(4-chlorophenyl)-2,3-diphenylprop-2-enyl] ester IUPAC Name: [(E)-3-(4-chlorophenyl)-2,3-diphenylprop-2-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-3-(4-chlorophenyl)-2,3-diphenyl-allyl] ester Formula: C28H23ClO3S MolecularWeight: 474.99842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(=C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC/C(=C(\C2=CC=CC=C2)/C3=CC=C(C=C3)Cl)/C4=CC=CC=C4

InChI

InChI=1S/C28H23ClO3S/c1-21-12-18-26(19-13-21)33(30,31)32-20-27(22-8-4-2-5-9-22)28(23-10-6-3-7-11-23)24-14-16-25(29)17-15-24/h2-19H,20H2,1H3/b28-27-