2-(2H-benzotriazol-5-yl)-4-methoxy-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(2H-benzotriazol-5-yl)-4-methoxy-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(2H-benzotriazol-5-yl)-4-methoxy-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(2H-benzotriazol-5-yl)-4-methoxy-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(2H-benzotriazol-5-yl)-4-methoxy-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(2H-benzotriazol-5-yl)-4-methoxy-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C15H14N4O3 MolecularWeight: 298.29666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1C=CCC2C1C(=O)N(C2=O)C3=CC4=NNN=C4C=C3

Isomeric SMILES

COC1C=CCC2C1C(=O)N(C2=O)C3=CC4=NNN=C4C=C3

InChI

InChI=1S/C15H14N4O3/c1-22-12-4-2-3-9-13(12)15(21)19(14(9)20)8-5-6-10-11(7-8)17-18-16-10/h2,4-7,9,12-13H,3H2,1H3,(H,16,17,18)