4-azanyl-3-ethanoyl-benzenesulfonic acid

Systemtic Name: 4-azanyl-3-ethanoyl-benzenesulfonic acid Openeye Name: 3-acetyl-4-amino-benzenesulfonic acid CAS Name: 3-acetyl-4-aminobenzenesulfonic acid IUPAC Name: 3-acetyl-4-aminobenzenesulfonic acid Traditional Name: 3-acetyl-4-amino-besylic acid Formula: C8H9NO4S MolecularWeight: 215.22636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)S(=O)(=O)O)N

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)S(=O)(=O)O)N

InChI

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