3a,7a-bis(bromanyl)-5-methyl-4,7-dihydro-2-benzofuran-1,3-dione

Systemtic Name: 3a,7a-bis(bromanyl)-5-methyl-4,7-dihydro-2-benzofuran-1,3-dione Openeye Name: 3a,7a-dibromo-5-methyl-4,7-dihydroisobenzofuran-1,3-dione CAS Name: 3a,7a-dibromo-5-methyl-4,7-dihydroisobenzofuran-1,3-dione IUPAC Name: 3a,7a-dibromo-5-methyl-4,7-dihydro-2-benzofuran-1,3-dione Traditional Name: 3a,7a-dibromo-5-methyl-4,7-dihydroisobenzofuran-1,3-quinone Formula: C9H8Br2O3 MolecularWeight: 323.96602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2(C(=O)OC(=O)C2(C1)Br)Br

Isomeric SMILES

CC1=CCC2(C(=O)OC(=O)C2(C1)Br)Br

InChI

InChI=1S/C9H8Br2O3/c1-5-2-3-8(10)6(12)14-7(13)9(8,11)4-5/h2H,3-4H2,1H3