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

Systemtic Name: 1,4,6,7-tetrahexyldibenzo-p-dioxin-2,3-diol Openeye Name: 1,4,6,7-tetrahexyldibenzo-p-dioxin-2,3-diol CAS Name: 1,4,6,7-tetrahexyldibenzo-p-dioxin-2,3-diol IUPAC Name: 1,4,6,7-tetrahexyldibenzo-p-dioxin-2,3-diol Traditional Name: 1,4,6,7-tetrahexyldibenzo-p-dioxin-2,3-diol Formula: C36H56O4 MolecularWeight: 552.82744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C1)OC3=C(C(=C(C(=C3O2)CCCCCC)O)O)CCCCCC)CCCCCC

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C1)OC3=C(C(=C(C(=C3O2)CCCCCC)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