ethyl 1-(3,3-dimethylbutanoyl)-4-methyl-5-(oxolan-2-ylmethylcarbamoyl)-2-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: ethyl 1-(3,3-dimethylbutanoyl)-4-methyl-5-(oxolan-2-ylmethylcarbamoyl)-2-phenyl-pyrrolidine-3-carboxylate Openeye Name: ethyl 1-(3,3-dimethylbutanoyl)-4-methyl-2-phenyl-5-(tetrahydrofuran-2-ylmethylcarbamoyl)pyrrolidine-3-carboxylate CAS Name: 1-(3,3-dimethyl-1-oxobutyl)-4-methyl-5-[oxo-(2-oxolanylmethylamino)methyl]-2-phenyl-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3,3-dimethylbutanoyl)-4-methyl-5-(oxolan-2-ylmethylcarbamoyl)-2-phenylpyrrolidine-3-carboxylate Traditional Name: 1-(3,3-dimethylbutanoyl)-4-methyl-2-phenyl-5-(tetrahydrofurfurylcarbamoyl)pyrrolidine-3-carboxylic acid ethyl ester Formula: C26H38N2O5 MolecularWeight: 458.59032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(N(C1C2=CC=CC=C2)C(=O)CC(C)(C)C)C(=O)NCC3CCCO3)C

Isomeric SMILES

CCOC(=O)C1C(C(N(C1C2=CC=CC=C2)C(=O)CC(C)(C)C)C(=O)NCC3CCCO3)C

InChI

InChI=1S/C26H38N2O5/c1-6-32-25(31)21-17(2)22(24(30)27-16-19-13-10-14-33-19)28(20(29)15-26(3,4)5)23(21)18-11-8-7-9-12-18/h7-9,11-12,17,19,21-23H,6,10,13-16H2,1-5H3,(H,27,30)