N-(3-chloranyl-4-cyano-phenyl)-1-(3-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-1-(3-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-1-(3-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-(3-chloro-4-cyanophenyl)-1-[(3-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-1-(3-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-1-(3-fluorobenzoyl)isonipecotamide Formula: C20H17ClFN3O2 MolecularWeight: 385.819283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)C#N)Cl)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)C#N)Cl)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C20H17ClFN3O2/c21-18-11-17(5-4-15(18)12-23)24-19(26)13-6-8-25(9-7-13)20(27)14-2-1-3-16(22)10-14/h1-5,10-11,13H,6-9H2,(H,24,26)