dialuminum 3,4,5,6-tetrakis(bromanyl)phthalate

Systemtic Name: dialuminum 3,4,5,6-tetrakis(bromanyl)phthalate Openeye Name: dialuminum 3,4,5,6-tetrabromophthalate CAS Name: dialuminum 3,4,5,6-tetrabromophthalate IUPAC Name: dialuminum 3,4,5,6-tetrabromophthalate Traditional Name: dialuminum 3,4,5,6-tetrabromophthalate Formula: C24Al2Br12O12 MolecularWeight: 1493.060676

Click to see the large picture

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-].C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)[O-])C(=O)[O-].[Al+3].[Al+3]

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-].C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)[O-])C(=O)[O-].[Al+3].[Al+3]

InChI

InChI=1S/3C8H2Br4O4.2Al/c3*9-3-1(7(13)14)2(8(15)16)4(10)6(12)5(3)11;;/h3*(H,13,14)(H,15,16);;/q;;;2*+3/p-6