2-(3-imidazol-1-ylpropylamino)pyridine-3-carboxylic acid

Systemtic Name: 2-(3-imidazol-1-ylpropylamino)pyridine-3-carboxylic acid Openeye Name: 2-(3-imidazol-1-ylpropylamino)pyridine-3-carboxylic acid CAS Name: 2-[3-(1-imidazolyl)propylamino]-3-pyridinecarboxylic acid IUPAC Name: 2-(3-imidazol-1-ylpropylamino)pyridine-3-carboxylic acid Traditional Name: 2-(3-imidazol-1-ylpropylamino)nicotinic acid Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NCCCN2C=CN=C2)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)NCCCN2C=CN=C2)C(=O)O

InChI

InChI=1S/C12H14N4O2/c17-12(18)10-3-1-4-14-11(10)15-5-2-7-16-8-6-13-9-16/h1,3-4,6,8-9H,2,5,7H2,(H,14,15)(H,17,18)