diethyl 2-[(2R,5S)-5-ethoxycarbonyl-5-methyl-1-(phenylcarbonyl)pyrrolidin-2-yl]propanedioate

Systemtic Name: diethyl 2-[(2R,5S)-5-ethoxycarbonyl-5-methyl-1-(phenylcarbonyl)pyrrolidin-2-yl]propanedioate Openeye Name: diethyl 2-[(2R,5S)-1-benzoyl-5-ethoxycarbonyl-5-methyl-pyrrolidin-2-yl]propanedioate CAS Name: 2-[(2R,5S)-1-benzoyl-5-ethoxycarbonyl-5-methyl-2-pyrrolidinyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2R,5S)-1-benzoyl-5-ethoxycarbonyl-5-methylpyrrolidin-2-yl]propanedioate Traditional Name: 2-[(2R,5S)-1-benzoyl-5-carbethoxy-5-methyl-pyrrolidin-2-yl]malonic acid diethyl ester Formula: C22H29NO7 MolecularWeight: 419.46816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1CCC(N1C(=O)C2=CC=CC=C2)(C)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C([C@H]1CC[C@@](N1C(=O)C2=CC=CC=C2)(C)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C22H29NO7/c1-5-28-19(25)17(20(26)29-6-2)16-13-14-22(4,21(27)30-7-3)23(16)18(24)15-11-9-8-10-12-15/h8-12,16-17H,5-7,13-14H2,1-4H3/t16-,22+/m1/s1