2-(3-azanylpropylamino)pyridine-3-carboxylic acid

Systemtic Name: 2-(3-azanylpropylamino)pyridine-3-carboxylic acid Openeye Name: 2-(3-aminopropylamino)pyridine-3-carboxylic acid CAS Name: 2-(3-aminopropylamino)-3-pyridinecarboxylic acid IUPAC Name: 2-(3-aminopropylamino)pyridine-3-carboxylic acid Traditional Name: 2-(3-aminopropylamino)nicotinic acid Formula: C9H13N3O2 MolecularWeight: 195.21842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NCCCN)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)NCCCN)C(=O)O

InChI

InChI=1S/C9H13N3O2/c10-4-2-6-12-8-7(9(13)14)3-1-5-11-8/h1,3,5H,2,4,6,10H2,(H,11,12)(H,13,14)