2-piperazin-4-ium-1-ylpyridine-3-carboxylic acid

Systemtic Name: 2-piperazin-4-ium-1-ylpyridine-3-carboxylic acid Openeye Name: 2-piperazin-4-ium-1-ylpyridine-3-carboxylic acid CAS Name: 2-(1-piperazin-4-iumyl)-3-pyridinecarboxylic acid IUPAC Name: 2-piperazin-4-ium-1-ylpyridine-3-carboxylic acid Traditional Name: 2-piperazin-4-ium-1-ylnicotinic acid Formula: C10H14N3O2+ MolecularWeight: 208.23706

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=C(C=CC=N2)C(=O)O

Isomeric SMILES

C1CN(CC[NH2+]1)C2=C(C=CC=N2)C(=O)O

InChI

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