(2R)-3-acetamido-2-[methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]propanoic acid

Systemtic Name: (2R)-3-acetamido-2-[methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]propanoic acid Openeye Name: (2R)-3-acetamido-2-[methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]propanoic acid CAS Name: (2R)-3-acetamido-2-[methyl-(2,4,6-trimethylphenyl)sulfonylamino]propanoic acid IUPAC Name: (2R)-3-acetamido-2-[methyl-(2,4,6-trimethylphenyl)sulfonylamino]propanoic acid Traditional Name: (2R)-3-acetamido-2-[mesitylsulfonyl(methyl)amino]propionic acid Formula: C15H22N2O5S MolecularWeight: 342.41058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(C)[C@H](CNC(=O)C)C(=O)O)C

InChI

InChI=1S/C15H22N2O5S/c1-9-6-10(2)14(11(3)7-9)23(21,22)17(5)13(15(19)20)8-16-12(4)18/h6-7,13H,8H2,1-5H3,(H,16,18)(H,19,20)/t13-/m1/s1