sodium 4-azanylbenzenesulfonate dihydrate

Systemtic Name: sodium 4-azanylbenzenesulfonate dihydrate Openeye Name: sodium 4-aminobenzenesulfonate dihydrate CAS Name: sodium 4-aminobenzenesulfonate dihydrate IUPAC Name: sodium 4-aminobenzenesulfonate dihydrate Traditional Name: sodium 4-aminobesylate dihydrate Formula: C6H10NNaO5S MolecularWeight: 231.20207

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H7NO3S.Na.2H2O/c7-5-1-3-6(4-2-5)11(8,9)10;;;/h1-4H,7H2,(H,8,9,10);;2*1H2/q;+1;;/p-1