4-chloranyl-3-(pyridin-2-ylmethylamino)benzoic acid

Systemtic Name: 4-chloranyl-3-(pyridin-2-ylmethylamino)benzoic acid Openeye Name: 4-chloro-3-(2-pyridylmethylamino)benzoic acid CAS Name: 4-chloro-3-(2-pyridinylmethylamino)benzoic acid IUPAC Name: 4-chloro-3-(pyridin-2-ylmethylamino)benzoic acid Traditional Name: 4-chloro-3-(2-pyridylmethylamino)benzoic acid Formula: C13H11ClN2O2 MolecularWeight: 262.69164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClN2O2/c14-11-5-4-9(13(17)18)7-12(11)16-8-10-3-1-2-6-15-10/h1-7,16H,8H2,(H,17,18)