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

Systemtic Name: [4-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]phenyl] 4-bromanylbenzenesulfonate Openeye Name: [4-[(E)-3-(4-isopropylphenyl)prop-2-enoyl]phenyl] 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid [4-[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]phenyl] 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid [4-[(E)-3-p-cumenylacryloyl]phenyl] ester Formula: C24H21BrO4S MolecularWeight: 485.39014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C24H21BrO4S/c1-17(2)19-6-3-18(4-7-19)5-16-24(26)20-8-12-22(13-9-20)29-30(27,28)23-14-10-21(25)11-15-23/h3-17H,1-2H3/b16-5+