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

Systemtic Name: 4,6,7,8-tetrakis(bromanyl)-1-methyl-dibenzo-p-dioxin-2,3-diol Openeye Name: 4,6,7,8-tetrabromo-1-methyl-dibenzo-p-dioxin-2,3-diol CAS Name: 4,6,7,8-tetrabromo-1-methyldibenzo-p-dioxin-2,3-diol IUPAC Name: 4,6,7,8-tetrabromo-1-methyldibenzo-p-dioxin-2,3-diol Traditional Name: 4,6,7,8-tetrabromo-1-methyl-dibenzo-p-dioxin-2,3-diol Formula: C13H6Br4O4 MolecularWeight: 545.80034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1O)O)Br)OC3=C(C(=C(C=C3O2)Br)Br)Br

Isomeric SMILES

CC1=C2C(=C(C(=C1O)O)Br)OC3=C(C(=C(C=C3O2)Br)Br)Br

InChI

InChI=1S/C13H6Br4O4/c1-3-9(18)10(19)8(17)13-11(3)20-5-2-4(14)6(15)7(16)12(5)21-13/h2,18-19H,1H3