2-piperazin-4-ium-1-ylpyridine-4-carboxylate

Systemtic Name: 2-piperazin-4-ium-1-ylpyridine-4-carboxylate Openeye Name: 2-piperazin-4-ium-1-ylpyridine-4-carboxylate CAS Name: 2-(1-piperazin-4-iumyl)-4-pyridinecarboxylate IUPAC Name: 2-piperazin-4-ium-1-ylpyridine-4-carboxylate Traditional Name: 2-piperazin-4-ium-1-ylisonicotinate Formula: C10H13N3O2 MolecularWeight: 207.22912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13N3O2/c14-10(15)8-1-2-12-9(7-8)13-5-3-11-4-6-13/h1-2,7,11H,3-6H2,(H,14,15)