2-[(2-methylsulfonylphenyl)amino]propanoic acid

Systemtic Name: 2-[(2-methylsulfonylphenyl)amino]propanoic acid Openeye Name: 2-(2-methylsulfonylanilino)propanoic acid CAS Name: 2-(2-methylsulfonylanilino)propanoic acid IUPAC Name: 2-(2-methylsulfonylanilino)propanoic acid Traditional Name: 2-(2-mesylanilino)propionic acid Formula: C10H13NO4S MolecularWeight: 243.27952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=CC=CC=C1S(=O)(=O)C

Isomeric SMILES

CC(C(=O)O)NC1=CC=CC=C1S(=O)(=O)C

InChI

InChI=1S/C10H13NO4S/c1-7(10(12)13)11-8-5-3-4-6-9(8)16(2,14)15/h3-7,11H,1-2H3,(H,12,13)