2-(1,4-diazepan-4-ium-1-yl)pyridine-3-carboxamide

Systemtic Name: 2-(1,4-diazepan-4-ium-1-yl)pyridine-3-carboxamide Openeye Name: 2-(1,4-diazepan-4-ium-1-yl)pyridine-3-carboxamide CAS Name: 2-(1,4-diazepan-4-ium-1-yl)-3-pyridinecarboxamide IUPAC Name: 2-(1,4-diazepan-4-ium-1-yl)pyridine-3-carboxamide Traditional Name: 2-(1,4-diazepan-4-ium-1-yl)nicotinamide Formula: C11H17N4O+ MolecularWeight: 221.27888

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C2=C(C=CC=N2)C(=O)N

Isomeric SMILES

C1C[NH2+]CCN(C1)C2=C(C=CC=N2)C(=O)N

InChI

InChI=1S/C11H16N4O/c12-10(16)9-3-1-5-14-11(9)15-7-2-4-13-6-8-15/h1,3,5,13H,2,4,6-8H2,(H2,12,16)/p+1