6-[(phenylmethyl)amino]pyridine-3-carboxylic acid

Systemtic Name: 6-[(phenylmethyl)amino]pyridine-3-carboxylic acid Openeye Name: 6-(benzylamino)pyridine-3-carboxylic acid CAS Name: 6-[(phenylmethyl)amino]-3-pyridinecarboxylic acid IUPAC Name: 6-(benzylamino)pyridine-3-carboxylic acid Traditional Name: 6-(benzylamino)nicotinic acid Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H12N2O2/c16-13(17)11-6-7-12(15-9-11)14-8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,14,15)(H,16,17)