[4-(4-bromophenyl)-4-oxidanylidene-butyl] 2-(4-methylphenyl)carbonylbenzoate

Systemtic Name: [4-(4-bromophenyl)-4-oxidanylidene-butyl] 2-(4-methylphenyl)carbonylbenzoate Openeye Name: [4-(4-bromophenyl)-4-oxo-butyl] 2-(4-methylbenzoyl)benzoate CAS Name: 2-[(4-methylphenyl)-oxomethyl]benzoic acid [4-(4-bromophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-bromophenyl)-4-oxobutyl] 2-(4-methylbenzoyl)benzoate Traditional Name: 2-p-toluoylbenzoic acid [4-(4-bromophenyl)-4-keto-butyl] ester Formula: C25H21BrO4 MolecularWeight: 465.33584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCCCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCCCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C25H21BrO4/c1-17-8-10-19(11-9-17)24(28)21-5-2-3-6-22(21)25(29)30-16-4-7-23(27)18-12-14-20(26)15-13-18/h2-3,5-6,8-15H,4,7,16H2,1H3