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

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

Systemtic Name:1,4,6,7-tetrahexyldibenzo-p-dioxin-2,3-diolate
Openeye Name:1,4,6,7-tetrahexyldibenzo-p-dioxin-2,3-diolate
CAS Name:1,4,6,7-tetrahexyldibenzo-p-dioxin-2,3-diolate
IUPAC Name:1,4,6,7-tetrahexyldibenzo-p-dioxin-2,3-diolate
Traditional Name:1,4,6,7-tetrahexyldibenzo-p-dioxin-2,3-diolate
Formula: C36H54O4-2
MolecularWeight: 550.81156
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C1)OC3=C(O2)C(=C(C(=C3CCCCCC)[O-])[O-])CCCCCC)CCCCCC


Isomeric SMILES

CCCCCCC1=C(C2=C(C=C1)OC3=C(O2)C(=C(C(=C3CCCCCC)[O-])[O-])CCCCCC)CCCCCC


InChI

InChI=1S/C36H56O4/c1-5-9-13-17-21-27-25-26-31-34(28(27)22-18-14-10-6-2)40-36-30(24-20-16-12-8-4)33(38)32(37)29(35(36)39-31)23-19-15-11-7-3/h25-26,37-38H,5-24H2,1-4H3/p-2


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