aluminum 2-bromanylbenzenesulfonate

Systemtic Name: aluminum 2-bromanylbenzenesulfonate Openeye Name: aluminum 2-bromobenzenesulfonate CAS Name: aluminum 2-bromobenzenesulfonate IUPAC Name: aluminum 2-bromobenzenesulfonate Traditional Name: aluminum 2-bromobesylate Formula: C18H12AlBr3O9S3 MolecularWeight: 735.171018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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