1-(2-nitrophenyl)-N-(1-propylpiperidin-1-ium-4-yl)piperidine-4-carboxamide

Systemtic Name: 1-(2-nitrophenyl)-N-(1-propylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Openeye Name: 1-(2-nitrophenyl)-N-(1-propylpiperidin-1-ium-4-yl)piperidine-4-carboxamide CAS Name: 1-(2-nitrophenyl)-N-(1-propyl-4-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-nitrophenyl)-N-(1-propylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Traditional Name: 1-(2-nitrophenyl)-N-(1-propylpiperidin-1-ium-4-yl)isonipecotamide Formula: C20H31N4O3+ MolecularWeight: 375.48514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H30N4O3/c1-2-11-22-12-9-17(10-13-22)21-20(25)16-7-14-23(15-8-16)18-5-3-4-6-19(18)24(26)27/h3-6,16-17H,2,7-15H2,1H3,(H,21,25)/p+1