3-(4-oxidanylidene-6H-pyrazolo[1,5-a][1,3,5]triazin-8-yl)benzoic acid

Systemtic Name: 3-(4-oxidanylidene-6H-pyrazolo[1,5-a][1,3,5]triazin-8-yl)benzoic acid Openeye Name: 3-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-8-yl)benzoic acid CAS Name: 3-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-8-yl)benzoic acid IUPAC Name: 3-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-8-yl)benzoic acid Traditional Name: 3-(4-keto-6H-pyrazolo[1,5-a][1,3,5]triazin-8-yl)benzoic acid Formula: C12H8N4O3 MolecularWeight: 256.21692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C2=CNN3C2=NC=NC3=O

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C2=CNN3C2=NC=NC3=O

InChI

InChI=1S/C12H8N4O3/c17-11(18)8-3-1-2-7(4-8)9-5-15-16-10(9)13-6-14-12(16)19/h1-6,15H,(H,17,18)