1-(4-chloranyl-2-nitro-phenyl)carbonyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-chloranyl-2-nitro-phenyl)carbonyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(4-chloro-2-nitro-benzoyl)-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[(4-chloro-2-nitrophenyl)-oxomethyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-chloro-2-nitrobenzoyl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(4-chloro-2-nitro-benzoyl)-N-(3-pyridylmethyl)isonipecotamide Formula: C19H19ClN4O4 MolecularWeight: 402.83156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN4O4/c20-15-3-4-16(17(10-15)24(27)28)19(26)23-8-5-14(6-9-23)18(25)22-12-13-2-1-7-21-11-13/h1-4,7,10-11,14H,5-6,8-9,12H2,(H,22,25)