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

Systemtic Name: 6-piperazin-4-ium-1-ylpyridine-3-carboxylic acid Openeye Name: 6-piperazin-4-ium-1-ylpyridine-3-carboxylic acid CAS Name: 6-(1-piperazin-4-iumyl)-3-pyridinecarboxylic acid IUPAC Name: 6-piperazin-4-ium-1-ylpyridine-3-carboxylic acid Traditional Name: 6-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=NC=C(C=C2)C(=O)O

Isomeric SMILES

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

InChI

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