dimethyl (2S)-2-[(4-methylphenyl)sulfonylamino]butanedioate

Systemtic Name: dimethyl (2S)-2-[(4-methylphenyl)sulfonylamino]butanedioate Openeye Name: dimethyl (2S)-2-(p-tolylsulfonylamino)butanedioate CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]butanedioic acid dimethyl ester IUPAC Name: dimethyl (2S)-2-[(4-methylphenyl)sulfonylamino]butanedioate Traditional Name: (2S)-2-(tosylamino)succinic acid dimethyl ester Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC(=O)OC)C(=O)OC

InChI

InChI=1S/C13H17NO6S/c1-9-4-6-10(7-5-9)21(17,18)14-11(13(16)20-3)8-12(15)19-2/h4-7,11,14H,8H2,1-3H3/t11-/m0/s1