1,6,7,8,9-pentakis(bromanyl)-4-methyl-dibenzo-p-dioxin-2,3-diol

Systemtic Name: 1,6,7,8,9-pentakis(bromanyl)-4-methyl-dibenzo-p-dioxin-2,3-diol Openeye Name: 1,6,7,8,9-pentabromo-4-methyl-dibenzo-p-dioxin-2,3-diol CAS Name: 1,6,7,8,9-pentabromo-4-methyldibenzo-p-dioxin-2,3-diol IUPAC Name: 1,6,7,8,9-pentabromo-4-methyldibenzo-p-dioxin-2,3-diol Traditional Name: 1,6,7,8,9-pentabromo-4-methyl-dibenzo-p-dioxin-2,3-diol Formula: C13H5Br5O4 MolecularWeight: 624.6964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1O)O)Br)OC3=C(O2)C(=C(C(=C3Br)Br)Br)Br

Isomeric SMILES

CC1=C2C(=C(C(=C1O)O)Br)OC3=C(O2)C(=C(C(=C3Br)Br)Br)Br

InChI

InChI=1S/C13H5Br5O4/c1-2-8(19)9(20)7(18)13-10(2)21-11-5(16)3(14)4(15)6(17)12(11)22-13/h19-20H,1H3