N-(4-piperazin-4-ium-1-ylphenyl)pyridine-3-carboxamide

Systemtic Name: N-(4-piperazin-4-ium-1-ylphenyl)pyridine-3-carboxamide Openeye Name: N-(4-piperazin-4-ium-1-ylphenyl)pyridine-3-carboxamide CAS Name: N-[4-(1-piperazin-4-iumyl)phenyl]-3-pyridinecarboxamide IUPAC Name: N-(4-piperazin-4-ium-1-ylphenyl)pyridine-3-carboxamide Traditional Name: N-(4-piperazin-4-ium-1-ylphenyl)nicotinamide Formula: C16H19N4O+ MolecularWeight: 283.34826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC=C(C=C2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC=C(C=C2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C16H18N4O/c21-16(13-2-1-7-18-12-13)19-14-3-5-15(6-4-14)20-10-8-17-9-11-20/h1-7,12,17H,8-11H2,(H,19,21)/p+1