2-[methyl-(4-methylphenyl)sulfonyl-amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[methyl-(4-methylphenyl)sulfonyl-amino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[methyl(p-tolylsulfonyl)amino]propanoic acid CAS Name: 3-hydroxy-2-[methyl-(4-methylphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-hydroxy-2-[methyl-(4-methylphenyl)sulfonylamino]propanoic acid Traditional Name: 3-hydroxy-2-[methyl(tosyl)amino]propionic acid Formula: C11H15NO5S MolecularWeight: 273.3055

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C(CO)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C(CO)C(=O)O

InChI

InChI=1S/C11H15NO5S/c1-8-3-5-9(6-4-8)18(16,17)12(2)10(7-13)11(14)15/h3-6,10,13H,7H2,1-2H3,(H,14,15)