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

Systemtic Name: 1-hexyldibenzo-p-dioxin-2,3-diolate Openeye Name: 1-hexyldibenzo-p-dioxin-2,3-diolate CAS Name: 1-hexyldibenzo-p-dioxin-2,3-diolate IUPAC Name: 1-hexyldibenzo-p-dioxin-2,3-diolate Traditional Name: 1-hexyldibenzo-p-dioxin-2,3-diolate Formula: C18H18O4-2 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=CC2=C1OC3=CC=CC=C3O2)[O-])[O-]

Isomeric SMILES

CCCCCCC1=C(C(=CC2=C1OC3=CC=CC=C3O2)[O-])[O-]

InChI

InChI=1S/C18H20O4/c1-2-3-4-5-8-12-17(20)13(19)11-16-18(12)22-15-10-7-6-9-14(15)21-16/h6-7,9-11,19-20H,2-5,8H2,1H3/p-2