N-[2-(4-pyridin-3-ylcarbonylpiperazin-1-ium-1-yl)ethyl]pyridine-4-carboxamide

Systemtic Name: N-[2-(4-pyridin-3-ylcarbonylpiperazin-1-ium-1-yl)ethyl]pyridine-4-carboxamide Openeye Name: N-[2-[4-(pyridine-3-carbonyl)piperazin-1-ium-1-yl]ethyl]pyridine-4-carboxamide CAS Name: N-[2-[4-[oxo(3-pyridinyl)methyl]-1-piperazin-1-iumyl]ethyl]-4-pyridinecarboxamide IUPAC Name: N-[2-[4-(pyridine-3-carbonyl)piperazin-1-ium-1-yl]ethyl]pyridine-4-carboxamide Traditional Name: N-[2-(4-nicotinoylpiperazin-1-ium-1-yl)ethyl]isonicotinamide Formula: C18H22N5O2+ MolecularWeight: 340.39958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)C2=CC=NC=C2)C(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)C2=CC=NC=C2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C18H21N5O2/c24-17(15-3-6-19-7-4-15)21-8-9-22-10-12-23(13-11-22)18(25)16-2-1-5-20-14-16/h1-7,14H,8-13H2,(H,21,24)/p+1