methyl (2S,3R,4R,5S)-4-(2-methylpropanoyl)-5-phenyl-3-(phenylsulfonyl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,3R,4R,5S)-4-(2-methylpropanoyl)-5-phenyl-3-(phenylsulfonyl)pyrrolidine-2-carboxylate Openeye Name: methyl (2S,3R,4R,5S)-3-(benzenesulfonyl)-4-(2-methylpropanoyl)-5-phenyl-pyrrolidine-2-carboxylate CAS Name: (2S,3R,4R,5S)-3-(benzenesulfonyl)-4-(2-methyl-1-oxopropyl)-5-phenyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3R,4R,5S)-3-(benzenesulfonyl)-4-(2-methylpropanoyl)-5-phenylpyrrolidine-2-carboxylate Traditional Name: (2S,3R,4R,5S)-3-besyl-4-isobutyryl-5-phenyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1C(C(NC1C2=CC=CC=C2)C(=O)OC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)[C@@H]1[C@H]([C@@H](N[C@@H]1C2=CC=CC=C2)C(=O)OC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO5S/c1-14(2)20(24)17-18(15-10-6-4-7-11-15)23-19(22(25)28-3)21(17)29(26,27)16-12-8-5-9-13-16/h4-14,17-19,21,23H,1-3H3/t17-,18-,19-,21-/m1/s1