N-ethyl-6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carboxamide

Systemtic Name: N-ethyl-6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carboxamide Openeye Name: N-ethyl-6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carboxamide CAS Name: N-ethyl-6-(4-methyl-1-piperazin-4-iumyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-ethyl-6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carboxamide Traditional Name: N-ethyl-6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carboxamide Formula: C13H22N4O+2 MolecularWeight: 250.33998

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C[NH+]=C(C=C1)N2CC[NH+](CC2)C

Isomeric SMILES

CCNC(=O)C1=C[NH+]=C(C=C1)N2CC[NH+](CC2)C

InChI

InChI=1S/C13H20N4O/c1-3-14-13(18)11-4-5-12(15-10-11)17-8-6-16(2)7-9-17/h4-5,10H,3,6-9H2,1-2H3,(H,14,18)/p+2