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

Systemtic Name: N-ethyl-2-piperazin-4-ium-1-yl-pyridine-3-carboxamide Openeye Name: N-ethyl-2-piperazin-4-ium-1-yl-pyridine-3-carboxamide CAS Name: N-ethyl-2-(1-piperazin-4-iumyl)-3-pyridinecarboxamide IUPAC Name: N-ethyl-2-piperazin-4-ium-1-ylpyridine-3-carboxamide Traditional Name: N-ethyl-2-piperazin-4-ium-1-yl-nicotinamide Formula: C12H19N4O+ MolecularWeight: 235.30546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N4O/c1-2-14-12(17)10-4-3-5-15-11(10)16-8-6-13-7-9-16/h3-5,13H,2,6-9H2,1H3,(H,14,17)/p+1