2-(4-methylpiperazin-4-ium-1-yl)pyridine-4-carboxylic acid

Systemtic Name: 2-(4-methylpiperazin-4-ium-1-yl)pyridine-4-carboxylic acid Openeye Name: 2-(4-methylpiperazin-4-ium-1-yl)pyridine-4-carboxylic acid CAS Name: 2-(4-methyl-1-piperazin-4-iumyl)-4-pyridinecarboxylic acid IUPAC Name: 2-(4-methylpiperazin-4-ium-1-yl)pyridine-4-carboxylic acid Traditional Name: 2-(4-methylpiperazin-4-ium-1-yl)isonicotinic acid Formula: C11H16N3O2+ MolecularWeight: 222.26364

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=CC(=C2)C(=O)O

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=CC(=C2)C(=O)O

InChI

InChI=1S/C11H15N3O2/c1-13-4-6-14(7-5-13)10-8-9(11(15)16)2-3-12-10/h2-3,8H,4-7H2,1H3,(H,15,16)/p+1