[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 5-bromanyl-2-chloranyl-benzoate Openeye Name: [2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid [2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid [2-keto-2-(4-piperidinoanilino)ethyl] ester Formula: C20H20BrClN2O3 MolecularWeight: 451.7414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)Br)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)Br)Cl

InChI

InChI=1S/C20H20BrClN2O3/c21-14-4-9-18(22)17(12-14)20(26)27-13-19(25)23-15-5-7-16(8-6-15)24-10-2-1-3-11-24/h4-9,12H,1-3,10-11,13H2,(H,23,25)