azanium 4-azanyl-2-ethanoyl-benzenesulfonate

Systemtic Name: azanium 4-azanyl-2-ethanoyl-benzenesulfonate Openeye Name: ammonium 2-acetyl-4-amino-benzenesulfonate CAS Name: ammonium 2-acetyl-4-aminobenzenesulfonate IUPAC Name: azanium 2-acetyl-4-aminobenzenesulfonate Traditional Name: ammonium 2-acetyl-4-amino-besylate Formula: C8H12N2O4S MolecularWeight: 232.25688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H9NO4S.H3N/c1-5(10)7-4-6(9)2-3-8(7)14(11,12)13;/h2-4H,9H2,1H3,(H,11,12,13);1H3