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1,4,6,7-tetraoctyldibenzo-p-dioxin-2,3-diolate

1,4,6,7-tetraoctyldibenzo-p-dioxin-2,3-diolate

Systemtic Name:1,4,6,7-tetraoctyldibenzo-p-dioxin-2,3-diolate
Openeye Name:1,4,6,7-tetraoctyldibenzo-p-dioxin-2,3-diolate
CAS Name:1,4,6,7-tetraoctyldibenzo-p-dioxin-2,3-diolate
IUPAC Name:1,4,6,7-tetraoctyldibenzo-p-dioxin-2,3-diolate
Traditional Name:1,4,6,7-tetraoctyldibenzo-p-dioxin-2,3-diolate
Formula: C44H70O4-2
MolecularWeight: 663.0242
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C2=C(C=C1)OC3=C(O2)C(=C(C(=C3CCCCCCCC)[O-])[O-])CCCCCCCC)CCCCCCCC


Isomeric SMILES

CCCCCCCCC1=C(C2=C(C=C1)OC3=C(O2)C(=C(C(=C3CCCCCCCC)[O-])[O-])CCCCCCCC)CCCCCCCC


InChI

InChI=1S/C44H72O4/c1-5-9-13-17-21-25-29-35-33-34-39-42(36(35)30-26-22-18-14-10-6-2)48-44-38(32-28-24-20-16-12-8-4)41(46)40(45)37(43(44)47-39)31-27-23-19-15-11-7-3/h33-34,45-46H,5-32H2,1-4H3/p-2


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