[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 5-bromanyl-2-fluoranyl-benzoate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 5-bromanyl-2-fluoranyl-benzoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 5-bromo-2-fluoro-benzoate CAS Name: 5-bromo-2-fluorobenzoic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 5-bromo-2-fluorobenzoate Traditional Name: 5-bromo-2-fluoro-benzoic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C16H12BrF2NO3 MolecularWeight: 384.172186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)COC(=O)C2=C(C=CC(=C2)Br)F)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)COC(=O)C2=C(C=CC(=C2)Br)F)F

InChI

InChI=1S/C16H12BrF2NO3/c17-11-3-6-14(19)13(7-11)16(22)23-9-15(21)20-8-10-1-4-12(18)5-2-10/h1-7H,8-9H2,(H,20,21)