aluminum 3-bromanylbenzenesulfonate

Systemtic Name: aluminum 3-bromanylbenzenesulfonate Openeye Name: aluminum 3-bromobenzenesulfonate CAS Name: aluminum 3-bromobenzenesulfonate IUPAC Name: aluminum 3-bromobenzenesulfonate Traditional Name: aluminum 3-bromobesylate Formula: C18H12AlBr3O9S3 MolecularWeight: 735.171018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)S(=O)(=O)[O-].C1=CC(=CC(=C1)Br)S(=O)(=O)[O-].C1=CC(=CC(=C1)Br)S(=O)(=O)[O-].[Al+3]

Isomeric SMILES

C1=CC(=CC(=C1)Br)S(=O)(=O)[O-].C1=CC(=CC(=C1)Br)S(=O)(=O)[O-].C1=CC(=CC(=C1)Br)S(=O)(=O)[O-].[Al+3]

InChI

InChI=1S/3C6H5BrO3S.Al/c3*7-5-2-1-3-6(4-5)11(8,9)10;/h3*1-4H,(H,8,9,10);/q;;;+3/p-3