1,4,6,7,8-pentabutyldibenzo-p-dioxin-2,3-diol

Systemtic Name: 1,4,6,7,8-pentabutyldibenzo-p-dioxin-2,3-diol Openeye Name: 1,4,6,7,8-pentabutyldibenzo-p-dioxin-2,3-diol CAS Name: 1,4,6,7,8-pentabutyldibenzo-p-dioxin-2,3-diol IUPAC Name: 1,4,6,7,8-pentabutyldibenzo-p-dioxin-2,3-diol Traditional Name: 1,4,6,7,8-pentabutyldibenzo-p-dioxin-2,3-diol Formula: C32H48O4 MolecularWeight: 496.72112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C(=C1CCCC)CCCC)OC3=C(C(=C(C(=C3O2)CCCC)O)O)CCCC

Isomeric SMILES

CCCCC1=CC2=C(C(=C1CCCC)CCCC)OC3=C(C(=C(C(=C3O2)CCCC)O)O)CCCC

InChI

InChI=1S/C32H48O4/c1-6-11-16-22-21-27-30(24(18-13-8-3)23(22)17-12-7-2)36-32-26(20-15-10-5)29(34)28(33)25(19-14-9-4)31(32)35-27/h21,33-34H,6-20H2,1-5H3