diethyl (2R,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-pentanedioate

Systemtic Name: diethyl (2R,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-pentanedioate Openeye Name: diethyl (3R,4R)-3-methyl-2-oxo-4-(p-tolylsulfonylamino)pentanedioate CAS Name: (2R,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-4-oxopentanedioic acid diethyl ester IUPAC Name: diethyl (2R,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-4-oxopentanedioate Traditional Name: (3R,4R)-2-keto-3-methyl-4-(tosylamino)glutaric acid diethyl ester Formula: C17H23NO7S MolecularWeight: 385.43202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)[C@@H]([C@@H](C)C(=O)C(=O)OCC)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C17H23NO7S/c1-5-24-16(20)14(12(4)15(19)17(21)25-6-2)18-26(22,23)13-9-7-11(3)8-10-13/h7-10,12,14,18H,5-6H2,1-4H3/t12-,14-/m1/s1