2-(benzotriazol-1-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(benzotriazol-1-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-(benzotriazol-1-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-(1-benzotriazolyl)-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(benzotriazol-1-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-(benzotriazol-1-yl)-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C14H12N4O2 MolecularWeight: 268.27068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N(C2=O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCC2=C(C1)C(=O)N(C2=O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C14H12N4O2/c19-13-9-5-1-2-6-10(9)14(20)17(13)18-12-8-4-3-7-11(12)15-16-18/h3-4,7-8H,1-2,5-6H2