2-(pyridin-4-ylmethylamino)pyridine-3-carboxylic acid

Systemtic Name: 2-(pyridin-4-ylmethylamino)pyridine-3-carboxylic acid Openeye Name: 2-(4-pyridylmethylamino)pyridine-3-carboxylic acid CAS Name: 2-(pyridin-4-ylmethylamino)-3-pyridinecarboxylic acid IUPAC Name: 2-(pyridin-4-ylmethylamino)pyridine-3-carboxylic acid Traditional Name: 2-(4-pyridylmethylamino)nicotinic acid Formula: C12H11N3O2 MolecularWeight: 229.23464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NCC2=CC=NC=C2)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)NCC2=CC=NC=C2)C(=O)O

InChI

InChI=1S/C12H11N3O2/c16-12(17)10-2-1-5-14-11(10)15-8-9-3-6-13-7-4-9/h1-7H,8H2,(H,14,15)(H,16,17)