(4-tert-butylphenyl)methyl (2S)-3-methyl-2-(phenylsulfonylamino)butanoate

Systemtic Name: (4-tert-butylphenyl)methyl (2S)-3-methyl-2-(phenylsulfonylamino)butanoate Openeye Name: (4-tert-butylphenyl)methyl (2S)-2-(benzenesulfonamido)-3-methyl-butanoate CAS Name: (2S)-2-(benzenesulfonamido)-3-methylbutanoic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl (2S)-2-(benzenesulfonamido)-3-methylbutanoate Traditional Name: (2S)-2-(benzenesulfonamido)-3-methyl-butyric acid (4-tert-butylbenzyl) ester Formula: C22H29NO4S MolecularWeight: 403.53496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=C(C=C1)C(C)(C)C)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC=C(C=C1)C(C)(C)C)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H29NO4S/c1-16(2)20(23-28(25,26)19-9-7-6-8-10-19)21(24)27-15-17-11-13-18(14-12-17)22(3,4)5/h6-14,16,20,23H,15H2,1-5H3/t20-/m0/s1