ethyl (2R,3S,4R)-3-(4-fluorophenyl)-4-(4-methylphenyl)sulfonyl-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2R,3S,4R)-3-(4-fluorophenyl)-4-(4-methylphenyl)sulfonyl-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-2-carboxylate Openeye Name: ethyl (2R,3S,4R)-1-benzyl-3-(4-fluorophenyl)-5-oxo-4-(p-tolylsulfonyl)pyrrolidine-2-carboxylate CAS Name: (2R,3S,4R)-3-(4-fluorophenyl)-4-(4-methylphenyl)sulfonyl-5-oxo-1-(phenylmethyl)-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3S,4R)-1-benzyl-3-(4-fluorophenyl)-4-(4-methylphenyl)sulfonyl-5-oxopyrrolidine-2-carboxylate Traditional Name: (2R,3S,4R)-1-benzyl-3-(4-fluorophenyl)-5-keto-4-tosyl-pyrrolidine-2-carboxylic acid ethyl ester Formula: C27H26FNO5S MolecularWeight: 495.562443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(C(=O)N1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H]([C@H](C(=O)N1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H26FNO5S/c1-3-34-27(31)24-23(20-11-13-21(28)14-12-20)25(35(32,33)22-15-9-18(2)10-16-22)26(30)29(24)17-19-7-5-4-6-8-19/h4-16,23-25H,3,17H2,1-2H3/t23-,24+,25+/m0/s1