2-(4,5-dimethyl-1,2,3-triazol-1-yl)isoindole-1,3-dione

Systemtic Name: 2-(4,5-dimethyl-1,2,3-triazol-1-yl)isoindole-1,3-dione Openeye Name: 2-(4,5-dimethyltriazol-1-yl)isoindoline-1,3-dione CAS Name: 2-(4,5-dimethyl-1-triazolyl)isoindole-1,3-dione IUPAC Name: 2-(4,5-dimethyltriazol-1-yl)isoindole-1,3-dione Traditional Name: 2-(4,5-dimethyltriazol-1-yl)isoindoline-1,3-quinone Formula: C12H10N4O2 MolecularWeight: 242.2334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=N1)N2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CC1=C(N(N=N1)N2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C12H10N4O2/c1-7-8(2)16(14-13-7)15-11(17)9-5-3-4-6-10(9)12(15)18/h3-6H,1-2H3