aluminum; 3,4,5,6-tetrakis(bromanyl)phthalate

Systemtic Name: aluminum; 3,4,5,6-tetrakis(bromanyl)phthalate Openeye Name: aluminum; 3,4,5,6-tetrabromophthalate CAS Name: aluminum; 3,4,5,6-tetrabromophthalate IUPAC Name: aluminum; 3,4,5,6-tetrabromophthalate Traditional Name: aluminum; 3,4,5,6-tetrabromophthalate Formula: C16Al3Br8O8-4 MolecularWeight: 1040.343014

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Descriptors Computed from Structure

Canonical SMILES:

C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)[O-])C(=O)[O-].C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)[O-])C(=O)[O-].[Al].[Al].[Al]

Isomeric SMILES

C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)[O-])C(=O)[O-].C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)[O-])C(=O)[O-].[Al].[Al].[Al]

InChI

InChI=1S/2C8H2Br4O4.3Al/c2*9-3-1(7(13)14)2(8(15)16)4(10)6(12)5(3)11;;;/h2*(H,13,14)(H,15,16);;;/p-4