(phenylmethyl) (2S,3S)-2,4-dimethyl-2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-pentanoate

Systemtic Name: (phenylmethyl) (2S,3S)-2,4-dimethyl-2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-pentanoate Openeye Name: benzyl (2S,3S)-3-hydroxy-2,4-dimethyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: (2S,3S)-3-hydroxy-2,4-dimethyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3S)-3-hydroxy-2,4-dimethyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: (2S,3S)-3-hydroxy-2,4-dimethyl-2-(tosylamino)valeric acid benzyl ester Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)(C(C(C)C)O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@](C)([C@H](C(C)C)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H27NO5S/c1-15(2)19(23)21(4,20(24)27-14-17-8-6-5-7-9-17)22-28(25,26)18-12-10-16(3)11-13-18/h5-13,15,19,22-23H,14H2,1-4H3/t19-,21-/m0/s1