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

Systemtic Name: N-(4-piperazin-4-ium-1-ylphenyl)pyridine-4-carboxamide Openeye Name: N-(4-piperazin-4-ium-1-ylphenyl)pyridine-4-carboxamide CAS Name: N-[4-(1-piperazin-4-iumyl)phenyl]-4-pyridinecarboxamide IUPAC Name: N-(4-piperazin-4-ium-1-ylphenyl)pyridine-4-carboxamide Traditional Name: N-(4-piperazin-4-ium-1-ylphenyl)isonicotinamide 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=CC=NC=C3

Isomeric SMILES

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

InChI

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