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

Systemtic Name: 1-(3-nitropyridin-1-ium-2-yl)-N-(phenylcarbamoyl)piperidine-4-carboxamide Openeye Name: 1-(3-nitropyridin-1-ium-2-yl)-N-(phenylcarbamoyl)piperidine-4-carboxamide CAS Name: N-[anilino(oxo)methyl]-1-(3-nitro-2-pyridin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-nitropyridin-1-ium-2-yl)-N-(phenylcarbamoyl)piperidine-4-carboxamide Traditional Name: 1-(3-nitropyridin-1-ium-2-yl)-N-(phenylcarbamoyl)isonipecotamide Formula: C18H20N5O4+ MolecularWeight: 370.3825

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(=O)NC2=CC=CC=C2)C3=C(C=CC=[NH+]3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC(=O)NC2=CC=CC=C2)C3=C(C=CC=[NH+]3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O4/c24-17(21-18(25)20-14-5-2-1-3-6-14)13-8-11-22(12-9-13)16-15(23(26)27)7-4-10-19-16/h1-7,10,13H,8-9,11-12H2,(H2,20,21,24,25)/p+1