O1-ethyl O4-phenyl (2S)-2-[(4-methylphenyl)sulfonylamino]butanedioate

Systemtic Name: O1-ethyl O4-phenyl (2S)-2-[(4-methylphenyl)sulfonylamino]butanedioate Openeye Name: O1-ethyl O4-phenyl (2S)-2-(p-tolylsulfonylamino)butanedioate CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]butanedioic acid O1-ethyl ester O4-phenyl ester IUPAC Name: 1-O-ethyl 4-O-phenyl (2S)-2-[(4-methylphenyl)sulfonylamino]butanedioate Traditional Name: (2S)-2-(tosylamino)succinic acid O1-ethyl ester O4-phenyl ester Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)OC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)[C@H](CC(=O)OC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H21NO6S/c1-3-25-19(22)17(13-18(21)26-15-7-5-4-6-8-15)20-27(23,24)16-11-9-14(2)10-12-16/h4-12,17,20H,3,13H2,1-2H3/t17-/m0/s1