2-[(3-ethanoylphenyl)sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[(3-ethanoylphenyl)sulfonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(3-acetylphenyl)sulfonylamino]-3-methyl-butanoic acid CAS Name: 2-[(3-acetylphenyl)sulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-[(3-acetylphenyl)sulfonylamino]-3-methylbutanoic acid Traditional Name: 2-[(3-acetylphenyl)sulfonylamino]-3-methyl-butyric acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO5S/c1-8(2)12(13(16)17)14-20(18,19)11-6-4-5-10(7-11)9(3)15/h4-8,12,14H,1-3H3,(H,16,17)