1-[4,4,4-tris(bromanyl)butyl]dibenzo-p-dioxin-2,3-diolate

Systemtic Name: 1-[4,4,4-tris(bromanyl)butyl]dibenzo-p-dioxin-2,3-diolate Openeye Name: 1-(4,4,4-tribromobutyl)dibenzo-p-dioxin-2,3-diolate CAS Name: 1-(4,4,4-tribromobutyl)dibenzo-p-dioxin-2,3-diolate IUPAC Name: 1-(4,4,4-tribromobutyl)dibenzo-p-dioxin-2,3-diolate Traditional Name: 1-(4,4,4-tribromobutyl)dibenzo-p-dioxin-2,3-diolate Formula: C16H11Br3O4-2 MolecularWeight: 506.96814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)OC3=C(O2)C(=C(C(=C3)[O-])[O-])CCCC(Br)(Br)Br

Isomeric SMILES

C1=CC=C2C(=C1)OC3=C(O2)C(=C(C(=C3)[O-])[O-])CCCC(Br)(Br)Br

InChI

InChI=1S/C16H13Br3O4/c17-16(18,19)7-3-4-9-14(21)10(20)8-13-15(9)23-12-6-2-1-5-11(12)22-13/h1-2,5-6,8,20-21H,3-4,7H2/p-2