(2R)-2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]propanoate

Systemtic Name: (2R)-2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]propanoate Openeye Name: (2R)-2-(3,5-dimethyl-N-methylsulfonyl-anilino)propanoate CAS Name: (2R)-2-(3,5-dimethyl-N-methylsulfonylanilino)propanoate IUPAC Name: (2R)-2-(3,5-dimethyl-N-methylsulfonylanilino)propanoate Traditional Name: (2R)-2-(N-mesyl-3,5-dimethyl-anilino)propionate Formula: C12H16NO4S- MolecularWeight: 270.32474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C(C)C(=O)[O-])S(=O)(=O)C)C

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO4S/c1-8-5-9(2)7-11(6-8)13(18(4,16)17)10(3)12(14)15/h5-7,10H,1-4H3,(H,14,15)/p-1/t10-/m1/s1