[2-oxidanylidene-1-phenyl-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [2-oxidanylidene-1-phenyl-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [2-keto-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C22H16ClF3N2O3 MolecularWeight: 448.82225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=CC(=C2)C(F)(F)F)OC(=O)C3=CC(=C(C=C3)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=CC(=C2)C(F)(F)F)OC(=O)C3=CC(=C(C=C3)Cl)N

InChI

InChI=1S/C22H16ClF3N2O3/c23-17-10-9-14(11-18(17)27)21(30)31-19(13-5-2-1-3-6-13)20(29)28-16-8-4-7-15(12-16)22(24,25)26/h1-12,19H,27H2,(H,28,29)