1-octyldibenzo-p-dioxin-2,3-diolate

Systemtic Name: 1-octyldibenzo-p-dioxin-2,3-diolate Openeye Name: 1-octyldibenzo-p-dioxin-2,3-diolate CAS Name: 1-octyldibenzo-p-dioxin-2,3-diolate IUPAC Name: 1-octyldibenzo-p-dioxin-2,3-diolate Traditional Name: 1-octyldibenzo-p-dioxin-2,3-diolate Formula: C20H22O4-2 MolecularWeight: 326.38628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=CC2=C1OC3=CC=CC=C3O2)[O-])[O-]

Isomeric SMILES

CCCCCCCCC1=C(C(=CC2=C1OC3=CC=CC=C3O2)[O-])[O-]

InChI

InChI=1S/C20H24O4/c1-2-3-4-5-6-7-10-14-19(22)15(21)13-18-20(14)24-17-12-9-8-11-16(17)23-18/h8-9,11-13,21-22H,2-7,10H2,1H3/p-2