3-heptyl-4,5,6-tris(iodanyl)benzene-1,2-diolate

Systemtic Name: 3-heptyl-4,5,6-tris(iodanyl)benzene-1,2-diolate Openeye Name: 3-heptyl-4,5,6-triiodo-benzene-1,2-diolate CAS Name: 3-heptyl-4,5,6-triiodobenzene-1,2-diolate IUPAC Name: 3-heptyl-4,5,6-triiodobenzene-1,2-diolate Traditional Name: 3-heptyl-4,5,6-triiodo-benzene-1,2-diolate Formula: C13H15I3O2-2 MolecularWeight: 583.97041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C(=C(C(=C1I)I)I)[O-])[O-]

Isomeric SMILES

CCCCCCCC1=C(C(=C(C(=C1I)I)I)[O-])[O-]

InChI

InChI=1S/C13H17I3O2/c1-2-3-4-5-6-7-8-9(14)10(15)11(16)13(18)12(8)17/h17-18H,2-7H2,1H3/p-2