gallium 3-bromanylbenzenesulfonate

Systemtic Name: gallium 3-bromanylbenzenesulfonate Openeye Name: gallium 3-bromobenzenesulfonate CAS Name: gallium 3-bromobenzenesulfonate IUPAC Name: gallium 3-bromobenzenesulfonate Traditional Name: gallium 3-bromobesylate Formula: C18H12Br3GaO9S3 MolecularWeight: 777.91248

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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-].[Ga+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-].[Ga+3]

InChI

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