[4-(4-bromophenyl)-4-oxidanylidene-butyl] 2,3,6-tris(chloranyl)benzoate

Systemtic Name: [4-(4-bromophenyl)-4-oxidanylidene-butyl] 2,3,6-tris(chloranyl)benzoate Openeye Name: [4-(4-bromophenyl)-4-oxo-butyl] 2,3,6-trichlorobenzoate CAS Name: 2,3,6-trichlorobenzoic acid [4-(4-bromophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-bromophenyl)-4-oxobutyl] 2,3,6-trichlorobenzoate Traditional Name: 2,3,6-trichlorobenzoic acid [4-(4-bromophenyl)-4-keto-butyl] ester Formula: C17H12BrCl3O3 MolecularWeight: 450.53838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCOC(=O)C2=C(C=CC(=C2Cl)Cl)Cl)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCOC(=O)C2=C(C=CC(=C2Cl)Cl)Cl)Br

InChI

InChI=1S/C17H12BrCl3O3/c18-11-5-3-10(4-6-11)14(22)2-1-9-24-17(23)15-12(19)7-8-13(20)16(15)21/h3-8H,1-2,9H2