4-(5-azanylpyrimidin-2-yl)benzoic acid

Systemtic Name: 4-(5-azanylpyrimidin-2-yl)benzoic acid Openeye Name: 4-(5-aminopyrimidin-2-yl)benzoic acid CAS Name: 4-(5-amino-2-pyrimidinyl)benzoic acid IUPAC Name: 4-(5-aminopyrimidin-2-yl)benzoic acid Traditional Name: 4-(5-aminopyrimidin-2-yl)benzoic acid Formula: C11H9N3O2 MolecularWeight: 215.20806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=C(C=N2)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC=C(C=N2)N)C(=O)O

InChI

InChI=1S/C11H9N3O2/c12-9-5-13-10(14-6-9)7-1-3-8(4-2-7)11(15)16/h1-6H,12H2,(H,15,16)