3-[(3-ethanoylphenyl)sulfonylamino]butanoic acid

Systemtic Name: 3-[(3-ethanoylphenyl)sulfonylamino]butanoic acid Openeye Name: 3-[(3-acetylphenyl)sulfonylamino]butanoic acid CAS Name: 3-[(3-acetylphenyl)sulfonylamino]butanoic acid IUPAC Name: 3-[(3-acetylphenyl)sulfonylamino]butanoic acid Traditional Name: 3-[(3-acetylphenyl)sulfonylamino]butyric acid Formula: C12H15NO5S MolecularWeight: 285.3162

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NS(=O)(=O)C1=CC=CC(=C1)C(=O)C

Isomeric SMILES

CC(CC(=O)O)NS(=O)(=O)C1=CC=CC(=C1)C(=O)C

InChI

InChI=1S/C12H15NO5S/c1-8(6-12(15)16)13-19(17,18)11-5-3-4-10(7-11)9(2)14/h3-5,7-8,13H,6H2,1-2H3,(H,15,16)