1-(4-chlorophenyl)carbonyl-N-(1H-1,2,4-triazol-5-yl)piperidine-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)carbonyl-N-(1H-1,2,4-triazol-5-yl)piperidine-3-carboxamide Openeye Name: 1-(4-chlorobenzoyl)-N-(1H-1,2,4-triazol-5-yl)piperidine-3-carboxamide CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-N-(1H-1,2,4-triazol-5-yl)-3-piperidinecarboxamide IUPAC Name: 1-(4-chlorobenzoyl)-N-(1H-1,2,4-triazol-5-yl)piperidine-3-carboxamide Traditional Name: 1-(4-chlorobenzoyl)-N-(1H-1,2,4-triazol-5-yl)nipecotamide Formula: C15H16ClN5O2 MolecularWeight: 333.77284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)NC3=NC=NN3

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)NC3=NC=NN3

InChI

InChI=1S/C15H16ClN5O2/c16-12-5-3-10(4-6-12)14(23)21-7-1-2-11(8-21)13(22)19-15-17-9-18-20-15/h3-6,9,11H,1-2,7-8H2,(H2,17,18,19,20,22)