4-(3-oxidanylidene-4,5-dihydro-2H-1,2,3-triazin-3-ium-6-yl)benzoic acid

Systemtic Name: 4-(3-oxidanylidene-4,5-dihydro-2H-1,2,3-triazin-3-ium-6-yl)benzoic acid Openeye Name: 4-(3-oxo-4,5-dihydro-2H-triazin-3-ium-6-yl)benzoic acid CAS Name: 4-(3-oxo-4,5-dihydro-2H-triazin-3-ium-6-yl)benzoic acid IUPAC Name: 4-(3-oxo-4,5-dihydro-2H-triazin-3-ium-6-yl)benzoic acid Traditional Name: 4-(3-keto-4,5-dihydro-2H-triazin-3-ium-6-yl)benzoic acid Formula: C10H10N3O3+ MolecularWeight: 220.2047

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=O)NN=C1C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1C[N+](=O)NN=C1C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C10H9N3O3/c14-10(15)8-3-1-7(2-4-8)9-5-6-13(16)12-11-9/h1-4H,5-6H2,(H-,12,14,15,16)/p+1