2-chloranyl-6-[(4,6-dimethoxypyrimidin-2-yl)amino]benzoic acid

Systemtic Name: 2-chloranyl-6-[(4,6-dimethoxypyrimidin-2-yl)amino]benzoic acid Openeye Name: 2-chloro-6-[(4,6-dimethoxypyrimidin-2-yl)amino]benzoic acid CAS Name: 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)amino]benzoic acid IUPAC Name: 2-chloro-6-[(4,6-dimethoxypyrimidin-2-yl)amino]benzoic acid Traditional Name: 2-chloro-6-[(4,6-dimethoxypyrimidin-2-yl)amino]benzoic acid Formula: C13H12ClN3O4 MolecularWeight: 309.70508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC2=C(C(=CC=C2)Cl)C(=O)O)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC2=C(C(=CC=C2)Cl)C(=O)O)OC

InChI

InChI=1S/C13H12ClN3O4/c1-20-9-6-10(21-2)17-13(16-9)15-8-5-3-4-7(14)11(8)12(18)19/h3-6H,1-2H3,(H,18,19)(H,15,16,17)