[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-[(E)-3-(4-methoxyphenyl)acryloyl]phenyl] ester Formula: C23H20O5S MolecularWeight: 408.4669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)C=CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)/C=C/C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H20O5S/c1-17-3-14-22(15-4-17)29(25,26)28-21-12-8-19(9-13-21)23(24)16-7-18-5-10-20(27-2)11-6-18/h3-16H,1-2H3/b16-7+