1,4,6,7-tetra(nonyl)dibenzo-p-dioxin-2,3-diol

Systemtic Name: 1,4,6,7-tetra(nonyl)dibenzo-p-dioxin-2,3-diol Openeye Name: 1,4,6,7-tetra(nonyl)dibenzo-p-dioxin-2,3-diol CAS Name: 1,4,6,7-tetra(nonyl)dibenzo-p-dioxin-2,3-diol IUPAC Name: 1,4,6,7-tetra(nonyl)dibenzo-p-dioxin-2,3-diol Traditional Name: 1,4,6,7-tetra(nonyl)dibenzo-p-dioxin-2,3-diol Formula: C48H80O4 MolecularWeight: 721.1464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C2=C(C=C1)OC3=C(C(=C(C(=C3O2)CCCCCCCCC)O)O)CCCCCCCCC)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC1=C(C2=C(C=C1)OC3=C(C(=C(C(=C3O2)CCCCCCCCC)O)O)CCCCCCCCC)CCCCCCCCC

InChI

InChI=1S/C48H80O4/c1-5-9-13-17-21-25-29-33-39-37-38-43-46(40(39)34-30-26-22-18-14-10-6-2)52-48-42(36-32-28-24-20-16-12-8-4)45(50)44(49)41(47(48)51-43)35-31-27-23-19-15-11-7-3/h37-38,49-50H,5-36H2,1-4H3