6,7-bis(bromanyl)-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate

Systemtic Name: 6,7-bis(bromanyl)-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate Openeye Name: 6,7-dibromo-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate CAS Name: 6,7-dibromo-1,4-diethyldibenzo-p-dioxin-2,3-diolate IUPAC Name: 6,7-dibromo-1,4-diethyldibenzo-p-dioxin-2,3-diolate Traditional Name: 6,7-dibromo-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate Formula: C16H12Br2O4-2 MolecularWeight: 428.07208

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C2=C1OC3=C(O2)C(=C(C=C3)Br)Br)CC)[O-])[O-]

Isomeric SMILES

CCC1=C(C(=C(C2=C1OC3=C(O2)C(=C(C=C3)Br)Br)CC)[O-])[O-]

InChI

InChI=1S/C16H14Br2O4/c1-3-7-12(19)13(20)8(4-2)15-14(7)21-10-6-5-9(17)11(18)16(10)22-15/h5-6,19-20H,3-4H2,1-2H3/p-2