2-(3-methylphenyl)-3-oxidanylidene-1H-1,2,4-triazole-5-carboxylic acid

Systemtic Name: 2-(3-methylphenyl)-3-oxidanylidene-1H-1,2,4-triazole-5-carboxylic acid Openeye Name: 2-(m-tolyl)-3-oxo-1H-1,2,4-triazole-5-carboxylic acid CAS Name: 2-(3-methylphenyl)-3-oxo-1H-1,2,4-triazole-5-carboxylic acid IUPAC Name: 2-(3-methylphenyl)-3-oxo-1H-1,2,4-triazole-5-carboxylic acid Traditional Name: 3-keto-2-(m-tolyl)-1H-1,2,4-triazole-5-carboxylic acid Formula: C10H9N3O3 MolecularWeight: 219.19676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)N=C(N2)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)N=C(N2)C(=O)O

InChI

InChI=1S/C10H9N3O3/c1-6-3-2-4-7(5-6)13-10(16)11-8(12-13)9(14)15/h2-5H,1H3,(H,14,15)(H,11,12,16)