2-piperazin-4-ium-1-yl-N-propyl-pyridine-3-carboxamide

Systemtic Name: 2-piperazin-4-ium-1-yl-N-propyl-pyridine-3-carboxamide Openeye Name: 2-piperazin-4-ium-1-yl-N-propyl-pyridine-3-carboxamide CAS Name: 2-(1-piperazin-4-iumyl)-N-propyl-3-pyridinecarboxamide IUPAC Name: 2-piperazin-4-ium-1-yl-N-propylpyridine-3-carboxamide Traditional Name: 2-piperazin-4-ium-1-yl-N-propyl-nicotinamide Formula: C13H21N4O+ MolecularWeight: 249.33204

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(N=CC=C1)N2CC[NH2+]CC2

Isomeric SMILES

CCCNC(=O)C1=C(N=CC=C1)N2CC[NH2+]CC2

InChI

InChI=1S/C13H20N4O/c1-2-5-16-13(18)11-4-3-6-15-12(11)17-9-7-14-8-10-17/h3-4,6,14H,2,5,7-10H2,1H3,(H,16,18)/p+1