3-(4-pyridin-3-ylcarbonylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: 3-(4-pyridin-3-ylcarbonylpiperazin-1-ium-1-yl)propanamide Openeye Name: 3-[4-(pyridine-3-carbonyl)piperazin-1-ium-1-yl]propanamide CAS Name: 3-[4-[oxo(3-pyridinyl)methyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: 3-[4-(pyridine-3-carbonyl)piperazin-1-ium-1-yl]propanamide Traditional Name: 3-(4-nicotinoylpiperazin-1-ium-1-yl)propionamide Formula: C13H19N4O2+ MolecularWeight: 263.31556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)N)C(=O)C2=CN=CC=C2

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)N)C(=O)C2=CN=CC=C2

InChI

InChI=1S/C13H18N4O2/c14-12(18)3-5-16-6-8-17(9-7-16)13(19)11-2-1-4-15-10-11/h1-2,4,10H,3,5-9H2,(H2,14,18)/p+1