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6,7,8-tris(bromanyl)-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate

6,7,8-tris(bromanyl)-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate

Systemtic Name:6,7,8-tris(bromanyl)-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate
Openeye Name:6,7,8-tribromo-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate
CAS Name:6,7,8-tribromo-1,4-diethyldibenzo-p-dioxin-2,3-diolate
IUPAC Name:6,7,8-tribromo-1,4-diethyldibenzo-p-dioxin-2,3-diolate
Traditional Name:6,7,8-tribromo-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate
Formula: C16H11Br3O4-2
MolecularWeight: 506.96814
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C2=C1OC3=CC(=C(C(=C3O2)Br)Br)Br)CC)[O-])[O-]


Isomeric SMILES

CCC1=C(C(=C(C2=C1OC3=CC(=C(C(=C3O2)Br)Br)Br)CC)[O-])[O-]


InChI

InChI=1S/C16H13Br3O4/c1-3-6-12(20)13(21)7(4-2)15-14(6)22-9-5-8(17)10(18)11(19)16(9)23-15/h5,20-21H,3-4H2,1-2H3/p-2


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