6-bromanyl-1,4-dipropyl-dibenzo-p-dioxin-2,3-diolate

Systemtic Name: 6-bromanyl-1,4-dipropyl-dibenzo-p-dioxin-2,3-diolate Openeye Name: 6-bromo-1,4-dipropyl-dibenzo-p-dioxin-2,3-diolate CAS Name: 6-bromo-1,4-dipropyldibenzo-p-dioxin-2,3-diolate IUPAC Name: 6-bromo-1,4-dipropyldibenzo-p-dioxin-2,3-diolate Traditional Name: 6-bromo-1,4-dipropyl-dibenzo-p-dioxin-2,3-diolate Formula: C18H17BrO4-2 MolecularWeight: 377.22918

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C2=C1OC3=C(O2)C(=CC=C3)Br)CCC)[O-])[O-]

Isomeric SMILES

CCCC1=C(C(=C(C2=C1OC3=C(O2)C(=CC=C3)Br)CCC)[O-])[O-]

InChI

InChI=1S/C18H19BrO4/c1-3-6-10-14(20)15(21)11(7-4-2)17-16(10)22-13-9-5-8-12(19)18(13)23-17/h5,8-9,20-21H,3-4,6-7H2,1-2H3/p-2