aluminum 2-oxidanylbenzenesulfonate

Systemtic Name: aluminum 2-oxidanylbenzenesulfonate Openeye Name: aluminum 2-hydroxybenzenesulfonate CAS Name: aluminum 2-hydroxybenzenesulfonate IUPAC Name: aluminum 2-hydroxybenzenesulfonate Traditional Name: aluminum 2-hydroxybesylate Formula: C18H15AlO12S3 MolecularWeight: 546.481038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C6H6O4S.Al/c3*7-5-3-1-2-4-6(5)11(8,9)10;/h3*1-4,7H,(H,8,9,10);/q;;;+3/p-3