[4-(4-bromophenyl)-4-oxidanylidene-butyl] 2-chloranyl-6-fluoranyl-benzoate

Systemtic Name: [4-(4-bromophenyl)-4-oxidanylidene-butyl] 2-chloranyl-6-fluoranyl-benzoate Openeye Name: [4-(4-bromophenyl)-4-oxo-butyl] 2-chloro-6-fluoro-benzoate CAS Name: 2-chloro-6-fluorobenzoic acid [4-(4-bromophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-bromophenyl)-4-oxobutyl] 2-chloro-6-fluorobenzoate Traditional Name: 2-chloro-6-fluoro-benzoic acid [4-(4-bromophenyl)-4-keto-butyl] ester Formula: C17H13BrClFO3 MolecularWeight: 399.638723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C(=O)OCCCC(=O)C2=CC=C(C=C2)Br)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)C(=O)OCCCC(=O)C2=CC=C(C=C2)Br)F

InChI

InChI=1S/C17H13BrClFO3/c18-12-8-6-11(7-9-12)15(21)5-2-10-23-17(22)16-13(19)3-1-4-14(16)20/h1,3-4,6-9H,2,5,10H2