azanium 2,5-dimethylbenzenesulfonate

Systemtic Name: azanium 2,5-dimethylbenzenesulfonate Openeye Name: ammonium 2,5-dimethylbenzenesulfonate CAS Name: ammonium 2,5-dimethylbenzenesulfonate IUPAC Name: azanium 2,5-dimethylbenzenesulfonate Traditional Name: ammonium 2,5-dimethylbesylate Formula: C8H13NO3S MolecularWeight: 203.25872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)[O-].[NH4+]

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)[O-].[NH4+]

InChI

InChI=1S/C8H10O3S.H3N/c1-6-3-4-7(2)8(5-6)12(9,10)11;/h3-5H,1-2H3,(H,9,10,11);1H3