propyl (2S)-1-(4-cyclohexyl-2-oxidanylidene-butanoyl)-3-phenyl-pyrrolidine-2-carboxylate

Systemtic Name: propyl (2S)-1-(4-cyclohexyl-2-oxidanylidene-butanoyl)-3-phenyl-pyrrolidine-2-carboxylate Openeye Name: propyl (2S)-1-(4-cyclohexyl-2-oxo-butanoyl)-3-phenyl-pyrrolidine-2-carboxylate CAS Name: (2S)-1-(4-cyclohexyl-1,2-dioxobutyl)-3-phenyl-2-pyrrolidinecarboxylic acid propyl ester IUPAC Name: propyl (2S)-1-(4-cyclohexyl-2-oxobutanoyl)-3-phenylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(4-cyclohexyl-2-keto-butanoyl)-3-phenyl-pyrrolidine-2-carboxylic acid propyl ester Formula: C24H33NO4 MolecularWeight: 399.52312

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1C(CCN1C(=O)C(=O)CCC2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CCCOC(=O)[C@@H]1C(CCN1C(=O)C(=O)CCC2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C24H33NO4/c1-2-17-29-24(28)22-20(19-11-7-4-8-12-19)15-16-25(22)23(27)21(26)14-13-18-9-5-3-6-10-18/h4,7-8,11-12,18,20,22H,2-3,5-6,9-10,13-17H2,1H3/t20?,22-/m0/s1