[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 2-bromanyl-5-fluoranyl-benzoate

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 2-bromanyl-5-fluoranyl-benzoate Openeye Name: [2-(4-acetamidoanilino)-2-oxo-ethyl] 2-bromo-5-fluoro-benzoate CAS Name: 2-bromo-5-fluorobenzoic acid [2-(4-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl] 2-bromo-5-fluorobenzoate Traditional Name: 2-bromo-5-fluoro-benzoic acid [2-(4-acetamidoanilino)-2-keto-ethyl] ester Formula: C17H14BrFN2O4 MolecularWeight: 409.206463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)COC(=O)C2=C(C=CC(=C2)F)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)COC(=O)C2=C(C=CC(=C2)F)Br

InChI

InChI=1S/C17H14BrFN2O4/c1-10(22)20-12-3-5-13(6-4-12)21-16(23)9-25-17(24)14-8-11(19)2-7-15(14)18/h2-8H,9H2,1H3,(H,20,22)(H,21,23)