methyl 2-[(4-methylphenyl)sulfonylamino]-3-methylsulfonyloxy-propanoate

Systemtic Name: methyl 2-[(4-methylphenyl)sulfonylamino]-3-methylsulfonyloxy-propanoate Openeye Name: methyl 3-methylsulfonyloxy-2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-3-methylsulfonyloxypropanoic acid methyl ester IUPAC Name: methyl 2-[(4-methylphenyl)sulfonylamino]-3-methylsulfonyloxypropanoate Traditional Name: 3-methylsulfonyloxy-2-(tosylamino)propionic acid methyl ester Formula: C12H17NO7S2 MolecularWeight: 351.39588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(COS(=O)(=O)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(COS(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C12H17NO7S2/c1-9-4-6-10(7-5-9)22(17,18)13-11(12(14)19-2)8-20-21(3,15)16/h4-7,11,13H,8H2,1-3H3