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

Systemtic Name: ethyl 2-[(4-methylphenyl)sulfonylamino]-3-methylsulfonyloxy-propanoate Openeye Name: ethyl 3-methylsulfonyloxy-2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-3-methylsulfonyloxypropanoic acid ethyl ester IUPAC Name: ethyl 2-[(4-methylphenyl)sulfonylamino]-3-methylsulfonyloxypropanoate Traditional Name: 3-methylsulfonyloxy-2-(tosylamino)propionic acid ethyl ester Formula: C13H19NO7S2 MolecularWeight: 365.42246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(COS(=O)(=O)C)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCOC(=O)C(COS(=O)(=O)C)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C13H19NO7S2/c1-4-20-13(15)12(9-21-22(3,16)17)14-23(18,19)11-7-5-10(2)6-8-11/h5-8,12,14H,4,9H2,1-3H3