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

Systemtic Name: 2-(pyridin-3-ylmethylamino)quinoline-4-carboxylic acid Openeye Name: 2-(3-pyridylmethylamino)quinoline-4-carboxylic acid CAS Name: 2-(3-pyridinylmethylamino)-4-quinolinecarboxylic acid IUPAC Name: 2-(pyridin-3-ylmethylamino)quinoline-4-carboxylic acid Traditional Name: 2-(3-pyridylmethylamino)cinchoninic acid Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)NCC3=CN=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)NCC3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C16H13N3O2/c20-16(21)13-8-15(18-10-11-4-3-7-17-9-11)19-14-6-2-1-5-12(13)14/h1-9H,10H2,(H,18,19)(H,20,21)