4-(2-azanylpyrimidin-4-yl)benzoate

Systemtic Name: 4-(2-azanylpyrimidin-4-yl)benzoate Openeye Name: 4-(2-aminopyrimidin-4-yl)benzoate CAS Name: 4-(2-amino-4-pyrimidinyl)benzoate IUPAC Name: 4-(2-aminopyrimidin-4-yl)benzoate Traditional Name: 4-(2-aminopyrimidin-4-yl)benzoate Formula: C11H8N3O2- MolecularWeight: 214.20012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NC=C2)N)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NC=C2)N)C(=O)[O-]

InChI

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