2-[4-[(5-nitropyridin-2-yl)amino]piperidin-1-ium-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(5-nitropyridin-2-yl)amino]piperidin-1-ium-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[(5-nitro-2-pyridyl)amino]piperidin-1-ium-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[(5-nitro-2-pyridinyl)amino]-1-piperidin-1-iumyl]-N-phenylacetamide IUPAC Name: 2-[4-[(5-nitropyridin-2-yl)amino]piperidin-1-ium-1-yl]-N-phenylacetamide Traditional Name: 2-[4-[(5-nitro-2-pyridyl)amino]piperidin-1-ium-1-yl]-N-phenyl-acetamide Formula: C18H22N5O3+ MolecularWeight: 356.39898

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2=NC=C(C=C2)[N+](=O)[O-])CC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC2=NC=C(C=C2)[N+](=O)[O-])CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H21N5O3/c24-18(21-14-4-2-1-3-5-14)13-22-10-8-15(9-11-22)20-17-7-6-16(12-19-17)23(25)26/h1-7,12,15H,8-11,13H2,(H,19,20)(H,21,24)/p+1