4-azanylbenzenesulfonate; titanium(4+)

Systemtic Name: 4-azanylbenzenesulfonate; titanium(4+) Openeye Name: 4-aminobenzenesulfonate; titanium(4+) CAS Name: 4-aminobenzenesulfonate; titanium(4+) IUPAC Name: 4-aminobenzenesulfonate; titanium(4+) Traditional Name: 4-aminobesylate; titanium(4+) Formula: C24H24N4O12S4Ti MolecularWeight: 736.59396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)S(=O)(=O)[O-].C1=CC(=CC=C1N)S(=O)(=O)[O-].C1=CC(=CC=C1N)S(=O)(=O)[O-].C1=CC(=CC=C1N)S(=O)(=O)[O-].[Ti+4]

Isomeric SMILES

C1=CC(=CC=C1N)S(=O)(=O)[O-].C1=CC(=CC=C1N)S(=O)(=O)[O-].C1=CC(=CC=C1N)S(=O)(=O)[O-].C1=CC(=CC=C1N)S(=O)(=O)[O-].[Ti+4]

InChI

InChI=1S/4C6H7NO3S.Ti/c4*7-5-1-3-6(4-2-5)11(8,9)10;/h4*1-4H,7H2,(H,8,9,10);/q;;;;+4/p-4