(phenylmethyl) (2S)-2-(4-methylphenyl)sulfonyl-2-[(2S)-5-oxidanylidene-1-propan-2-yl-pyrrolidin-2-yl]ethanoate

Systemtic Name: (phenylmethyl) (2S)-2-(4-methylphenyl)sulfonyl-2-[(2S)-5-oxidanylidene-1-propan-2-yl-pyrrolidin-2-yl]ethanoate Openeye Name: benzyl (2S)-2-[(2S)-1-isopropyl-5-oxo-pyrrolidin-2-yl]-2-(p-tolylsulfonyl)acetate CAS Name: (2S)-2-(4-methylphenyl)sulfonyl-2-[(2S)-5-oxo-1-propan-2-yl-2-pyrrolidinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(4-methylphenyl)sulfonyl-2-[(2S)-5-oxo-1-propan-2-ylpyrrolidin-2-yl]acetate Traditional Name: (2S)-2-[(2S)-1-isopropyl-5-keto-pyrrolidin-2-yl]-2-tosyl-acetic acid benzyl ester Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C2CCC(=O)N2C(C)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@@H]([C@@H]2CCC(=O)N2C(C)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H27NO5S/c1-16(2)24-20(13-14-21(24)25)22(23(26)29-15-18-7-5-4-6-8-18)30(27,28)19-11-9-17(3)10-12-19/h4-12,16,20,22H,13-15H2,1-3H3/t20-,22-/m0/s1