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1,4,6-trihexyldibenzo-p-dioxin-2,3-diolate

1,4,6-trihexyldibenzo-p-dioxin-2,3-diolate

Systemtic Name:1,4,6-trihexyldibenzo-p-dioxin-2,3-diolate
Openeye Name:1,4,6-trihexyldibenzo-p-dioxin-2,3-diolate
CAS Name:1,4,6-trihexyldibenzo-p-dioxin-2,3-diolate
IUPAC Name:1,4,6-trihexyldibenzo-p-dioxin-2,3-diolate
Traditional Name:1,4,6-trihexyldibenzo-p-dioxin-2,3-diolate
Formula: C30H42O4-2
MolecularWeight: 466.65208
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C(=CC=C1)OC3=C(O2)C(=C(C(=C3CCCCCC)[O-])[O-])CCCCCC


Isomeric SMILES

CCCCCCC1=C2C(=CC=C1)OC3=C(O2)C(=C(C(=C3CCCCCC)[O-])[O-])CCCCCC


InChI

InChI=1S/C30H44O4/c1-4-7-10-13-17-22-18-16-21-25-28(22)34-30-24(20-15-12-9-6-3)27(32)26(31)23(29(30)33-25)19-14-11-8-5-2/h16,18,21,31-32H,4-15,17,19-20H2,1-3H3/p-2


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