[2-oxidanylidene-2-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]amino]ethyl] 1H-pyrrole-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]amino]ethyl] 1H-pyrrole-2-carboxylate Openeye Name: [2-oxo-2-[2-(1-piperidyl)-5-(trifluoromethyl)anilino]ethyl] 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [2-oxo-2-[2-(1-piperidinyl)-5-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-piperidin-1-yl-5-(trifluoromethyl)anilino]ethyl] 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [2-keto-2-[2-piperidino-5-(trifluoromethyl)anilino]ethyl] ester Formula: C19H20F3N3O3 MolecularWeight: 395.37561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)COC(=O)C3=CC=CN3

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)COC(=O)C3=CC=CN3

InChI

InChI=1S/C19H20F3N3O3/c20-19(21,22)13-6-7-16(25-9-2-1-3-10-25)15(11-13)24-17(26)12-28-18(27)14-5-4-8-23-14/h4-8,11,23H,1-3,9-10,12H2,(H,24,26)