3-[1,3-bis(oxidanylidene)isoindol-2-yl]-1H-1,2,4-triazole-5-carboxylic acid

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-1H-1,2,4-triazole-5-carboxylic acid Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-1H-1,2,4-triazole-5-carboxylic acid CAS Name: 3-(1,3-dioxo-2-isoindolyl)-1H-1,2,4-triazole-5-carboxylic acid IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-1H-1,2,4-triazole-5-carboxylic acid Traditional Name: 3-phthalimido-1H-1,2,4-triazole-5-carboxylic acid Formula: C11H6N4O4 MolecularWeight: 258.18974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=NNC(=N3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=NNC(=N3)C(=O)O

InChI

InChI=1S/C11H6N4O4/c16-8-5-3-1-2-4-6(5)9(17)15(8)11-12-7(10(18)19)13-14-11/h1-4H,(H,18,19)(H,12,13,14)