[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 4-(trifluoromethyl)benzoate

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 4-(trifluoromethyl)benzoate Openeye Name: [2-(3-bromoanilino)-2-oxo-ethyl] 4-(trifluoromethyl)benzoate CAS Name: 4-(trifluoromethyl)benzoic acid [2-(3-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-bromoanilino)-2-oxoethyl] 4-(trifluoromethyl)benzoate Traditional Name: 4-(trifluoromethyl)benzoic acid [2-(3-bromoanilino)-2-keto-ethyl] ester Formula: C16H11BrF3NO3 MolecularWeight: 402.16265

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrF3NO3/c17-12-2-1-3-13(8-12)21-14(22)9-24-15(23)10-4-6-11(7-5-10)16(18,19)20/h1-8H,9H2,(H,21,22)