sodium 4-azanyl-2-ethanoyl-benzenesulfonate

Systemtic Name: sodium 4-azanyl-2-ethanoyl-benzenesulfonate Openeye Name: sodium 2-acetyl-4-amino-benzenesulfonate CAS Name: sodium 2-acetyl-4-aminobenzenesulfonate IUPAC Name: sodium 2-acetyl-4-aminobenzenesulfonate Traditional Name: sodium 2-acetyl-4-amino-besylate Formula: C8H8NNaO4S MolecularWeight: 237.20819

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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