1,4-diheptyldibenzo-p-dioxin-2,3-diol

Systemtic Name: 1,4-diheptyldibenzo-p-dioxin-2,3-diol Openeye Name: 1,4-diheptyldibenzo-p-dioxin-2,3-diol CAS Name: 1,4-diheptyldibenzo-p-dioxin-2,3-diol IUPAC Name: 1,4-diheptyldibenzo-p-dioxin-2,3-diol Traditional Name: 1,4-diheptyldibenzo-p-dioxin-2,3-diol Formula: C26H36O4 MolecularWeight: 412.56164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C2C(=C(C(=C1O)O)CCCCCCC)OC3=CC=CC=C3O2

Isomeric SMILES

CCCCCCCC1=C2C(=C(C(=C1O)O)CCCCCCC)OC3=CC=CC=C3O2

InChI

InChI=1S/C26H36O4/c1-3-5-7-9-11-15-19-23(27)24(28)20(16-12-10-8-6-4-2)26-25(19)29-21-17-13-14-18-22(21)30-26/h13-14,17-18,27-28H,3-12,15-16H2,1-2H3