2-(2-bromophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(2-bromophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(2-bromophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(2-bromophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(2-bromophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(2-bromophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C16H16BrNO2 MolecularWeight: 334.20774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC2C(C1)C(=O)N(C2=O)C3=CC=CC=C3Br)C

Isomeric SMILES

CC1=C(CC2C(C1)C(=O)N(C2=O)C3=CC=CC=C3Br)C

InChI

InChI=1S/C16H16BrNO2/c1-9-7-11-12(8-10(9)2)16(20)18(15(11)19)14-6-4-3-5-13(14)17/h3-6,11-12H,7-8H2,1-2H3