2-azanylethanoic acid; 2,2-bis(chloranyl)-N-[(1R,2R)-1-(4-methylsulfonylphenyl)-1,3-bis(oxidanyl)propan-2-yl]ethanamide

Systemtic Name: 2-azanylethanoic acid; 2,2-bis(chloranyl)-N-[(1R,2R)-1-(4-methylsulfonylphenyl)-1,3-bis(oxidanyl)propan-2-yl]ethanamide Openeye Name: 2-aminoacetic acid; 2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-methylsulfonylphenyl)ethyl]acetamide CAS Name: 2-aminoacetic acid; 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide IUPAC Name: 2-aminoacetic acid; 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide Traditional Name: 2-aminoacetic acid; 2,2-dichloro-N-[(1R,2R)-2-hydroxy-2-(4-mesylphenyl)-1-methylol-ethyl]acetamide Formula: C14H20Cl2N2O7S MolecularWeight: 431.2888

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(C(CO)NC(=O)C(Cl)Cl)O.C(C(=O)O)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O.C(C(=O)O)N

InChI

InChI=1S/C12H15Cl2NO5S.C2H5NO2/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-16)15-12(18)11(13)14;3-1-2(4)5/h2-5,9-11,16-17H,6H2,1H3,(H,15,18);1,3H2,(H,4,5)/t9-,10-;/m1./s1