4-(pyrimidin-2-ylcarbamoylamino)benzoic acid

Systemtic Name: 4-(pyrimidin-2-ylcarbamoylamino)benzoic acid Openeye Name: 4-(pyrimidin-2-ylcarbamoylamino)benzoic acid CAS Name: 4-[[oxo-(2-pyrimidinylamino)methyl]amino]benzoic acid IUPAC Name: 4-(pyrimidin-2-ylcarbamoylamino)benzoic acid Traditional Name: 4-(2-pyrimidylcarbamoylamino)benzoic acid Formula: C12H10N4O3 MolecularWeight: 258.2328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CN=C(N=C1)NC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H10N4O3/c17-10(18)8-2-4-9(5-3-8)15-12(19)16-11-13-6-1-7-14-11/h1-7H,(H,17,18)(H2,13,14,15,16,19)