2-(1-oxidanylidene-1-phenylazanyl-propan-2-yl)sulfonylpropanoic acid

Systemtic Name: 2-(1-oxidanylidene-1-phenylazanyl-propan-2-yl)sulfonylpropanoic acid Openeye Name: 2-(2-anilino-1-methyl-2-oxo-ethyl)sulfonylpropanoic acid CAS Name: 2-(1-anilino-1-oxopropan-2-yl)sulfonylpropanoic acid IUPAC Name: 2-(1-anilino-1-oxopropan-2-yl)sulfonylpropanoic acid Traditional Name: 2-(2-anilino-2-keto-1-methyl-ethyl)sulfonylpropionic acid Formula: C12H15NO5S MolecularWeight: 285.3162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)S(=O)(=O)C(C)C(=O)O

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)S(=O)(=O)C(C)C(=O)O

InChI

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