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

Systemtic Name: 1,6,7,8,9-pentakis(bromanyl)-4-methyl-dibenzo-p-dioxin-2,3-diolate Openeye Name: 1,6,7,8,9-pentabromo-4-methyl-dibenzo-p-dioxin-2,3-diolate CAS Name: 1,6,7,8,9-pentabromo-4-methyldibenzo-p-dioxin-2,3-diolate IUPAC Name: 1,6,7,8,9-pentabromo-4-methyldibenzo-p-dioxin-2,3-diolate Traditional Name: 1,6,7,8,9-pentabromo-4-methyl-dibenzo-p-dioxin-2,3-diolate Formula: C13H3Br5O4-2 MolecularWeight: 622.68052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1OC3=C(O2)C(=C(C(=C3Br)Br)Br)Br)Br)[O-])[O-]

Isomeric SMILES

CC1=C(C(=C(C2=C1OC3=C(O2)C(=C(C(=C3Br)Br)Br)Br)Br)[O-])[O-]

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/p-2