4-[[(3-aminocarbonylpyridin-2-yl)amino]methyl]benzoic acid

Systemtic Name: 4-[[(3-aminocarbonylpyridin-2-yl)amino]methyl]benzoic acid Openeye Name: 4-[[(3-carbamoyl-2-pyridyl)amino]methyl]benzoic acid CAS Name: 4-[[(3-carbamoyl-2-pyridinyl)amino]methyl]benzoic acid IUPAC Name: 4-[[(3-carbamoylpyridin-2-yl)amino]methyl]benzoic acid Traditional Name: 4-[[(3-carbamoyl-2-pyridyl)amino]methyl]benzoic acid Formula: C14H13N3O3 MolecularWeight: 271.27132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O3/c15-12(18)11-2-1-7-16-13(11)17-8-9-3-5-10(6-4-9)14(19)20/h1-7H,8H2,(H2,15,18)(H,16,17)(H,19,20)