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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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