(2-azanyl-2-oxidanylidene-ethyl) 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: (2-amino-2-oxo-ethyl) 3-methyl-2-(p-tolylsulfonylamino)butanoate CAS Name: 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: 3-methyl-2-(tosylamino)butyric acid (2-amino-2-keto-ethyl) ester Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OCC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OCC(=O)N

InChI

InChI=1S/C14H20N2O5S/c1-9(2)13(14(18)21-8-12(15)17)16-22(19,20)11-6-4-10(3)5-7-11/h4-7,9,13,16H,8H2,1-3H3,(H2,15,17)