[2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 2-azanyl-5-bromanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 2-azanyl-5-bromanyl-benzoate Openeye Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 2-amino-5-bromo-benzoate CAS Name: 2-amino-5-bromobenzoic acid [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 2-amino-5-bromobenzoate Traditional Name: 2-amino-5-bromo-benzoic acid [2-keto-2-(2,2,2-trifluoroethylamino)ethyl] ester Formula: C11H10BrF3N2O3 MolecularWeight: 355.10791

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)OCC(=O)NCC(F)(F)F)N

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)OCC(=O)NCC(F)(F)F)N

InChI

InChI=1S/C11H10BrF3N2O3/c12-6-1-2-8(16)7(3-6)10(19)20-4-9(18)17-5-11(13,14)15/h1-3H,4-5,16H2,(H,17,18)