1-(5-nitropyridin-1-ium-2-yl)-N-pyridin-3-yl-piperidine-4-carboxamide

Systemtic Name: 1-(5-nitropyridin-1-ium-2-yl)-N-pyridin-3-yl-piperidine-4-carboxamide Openeye Name: 1-(5-nitropyridin-1-ium-2-yl)-N-(3-pyridyl)piperidine-4-carboxamide CAS Name: 1-(5-nitro-2-pyridin-1-iumyl)-N-(3-pyridinyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-nitropyridin-1-ium-2-yl)-N-pyridin-3-ylpiperidine-4-carboxamide Traditional Name: 1-(5-nitropyridin-1-ium-2-yl)-N-(3-pyridyl)isonipecotamide Formula: C16H18N5O3+ MolecularWeight: 328.34582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CN=CC=C2)C3=[NH+]C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CN=CC=C2)C3=[NH+]C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O3/c22-16(19-13-2-1-7-17-10-13)12-5-8-20(9-6-12)15-4-3-14(11-18-15)21(23)24/h1-4,7,10-12H,5-6,8-9H2,(H,19,22)/p+1