2-(1H-1,2,4-triazol-5-ylmethyl)isoindole-1,3-dione

Systemtic Name: 2-(1H-1,2,4-triazol-5-ylmethyl)isoindole-1,3-dione Openeye Name: 2-(1H-1,2,4-triazol-5-ylmethyl)isoindoline-1,3-dione CAS Name: 2-(1H-1,2,4-triazol-5-ylmethyl)isoindole-1,3-dione IUPAC Name: 2-(1H-1,2,4-triazol-5-ylmethyl)isoindole-1,3-dione Traditional Name: 2-(1H-1,2,4-triazol-5-ylmethyl)isoindoline-1,3-quinone Formula: C11H8N4O2 MolecularWeight: 228.20682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=NC=NN3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=NC=NN3

InChI

InChI=1S/C11H8N4O2/c16-10-7-3-1-2-4-8(7)11(17)15(10)5-9-12-6-13-14-9/h1-4,6H,5H2,(H,12,13,14)