3-(pyrimidin-2-ylcarbamoyl)benzoic acid

Systemtic Name: 3-(pyrimidin-2-ylcarbamoyl)benzoic acid Openeye Name: 3-(pyrimidin-2-ylcarbamoyl)benzoic acid CAS Name: 3-[oxo-(2-pyrimidinylamino)methyl]benzoic acid IUPAC Name: 3-(pyrimidin-2-ylcarbamoyl)benzoic acid Traditional Name: 3-(2-pyrimidylcarbamoyl)benzoic acid Formula: C12H9N3O3 MolecularWeight: 243.21816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C(=O)NC2=NC=CC=N2

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C(=O)NC2=NC=CC=N2

InChI

InChI=1S/C12H9N3O3/c16-10(15-12-13-5-2-6-14-12)8-3-1-4-9(7-8)11(17)18/h1-7H,(H,17,18)(H,13,14,15,16)