4-(3-oxidanylidene-2H-1,2,4-triazin-6-yl)benzoic acid

Systemtic Name: 4-(3-oxidanylidene-2H-1,2,4-triazin-6-yl)benzoic acid Openeye Name: 4-(3-oxo-2H-1,2,4-triazin-6-yl)benzoic acid CAS Name: 4-(3-oxo-2H-1,2,4-triazin-6-yl)benzoic acid IUPAC Name: 4-(3-oxo-2H-1,2,4-triazin-6-yl)benzoic acid Traditional Name: 4-(3-keto-2H-1,2,4-triazin-6-yl)benzoic acid Formula: C10H7N3O3 MolecularWeight: 217.18088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NNC(=O)N=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NNC(=O)N=C2)C(=O)O

InChI

InChI=1S/C10H7N3O3/c14-9(15)7-3-1-6(2-4-7)8-5-11-10(16)13-12-8/h1-5H,(H,14,15)(H,11,13,16)