[3-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 4-methylbenzoate

Systemtic Name: [3-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 4-methylbenzoate Openeye Name: [3-[(E)-3-(4-bromophenyl)-3-oxo-prop-1-enyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [3-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [3-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [3-[(E)-3-(4-bromophenyl)-3-keto-prop-1-enyl]phenyl] ester Formula: C23H17BrO3 MolecularWeight: 421.28328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C=CC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C23H17BrO3/c1-16-5-8-19(9-6-16)23(26)27-21-4-2-3-17(15-21)7-14-22(25)18-10-12-20(24)13-11-18/h2-15H,1H3/b14-7+