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

Systemtic Name: [2-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-[(E)-3-(4-isopropylphenyl)prop-2-enoyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]phenyl] ester IUPAC Name: [2-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-[(E)-3-p-cumenylacryloyl]phenyl] ester Formula: C25H24O4S MolecularWeight: 420.52066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C(=O)C=CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C(=O)/C=C/C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C25H24O4S/c1-18(2)21-13-10-20(11-14-21)12-17-24(26)23-6-4-5-7-25(23)29-30(27,28)22-15-8-19(3)9-16-22/h4-18H,1-3H3/b17-12+