propyl (2S)-1-(3,3-dimethyl-2-oxidanylidene-butanoyl)-3,3-diphenyl-pyrrolidine-2-carboxylate

Systemtic Name: propyl (2S)-1-(3,3-dimethyl-2-oxidanylidene-butanoyl)-3,3-diphenyl-pyrrolidine-2-carboxylate Openeye Name: propyl (2S)-1-(3,3-dimethyl-2-oxo-butanoyl)-3,3-diphenyl-pyrrolidine-2-carboxylate CAS Name: (2S)-1-(3,3-dimethyl-1,2-dioxobutyl)-3,3-diphenyl-2-pyrrolidinecarboxylic acid propyl ester IUPAC Name: propyl (2S)-1-(3,3-dimethyl-2-oxobutanoyl)-3,3-diphenylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-keto-3,3-dimethyl-butanoyl)-3,3-diphenyl-pyrrolidine-2-carboxylic acid propyl ester Formula: C26H31NO4 MolecularWeight: 421.52864

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1C(CCN1C(=O)C(=O)C(C)(C)C)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCOC(=O)[C@@H]1C(CCN1C(=O)C(=O)C(C)(C)C)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H31NO4/c1-5-18-31-24(30)21-26(19-12-8-6-9-13-19,20-14-10-7-11-15-20)16-17-27(21)23(29)22(28)25(2,3)4/h6-15,21H,5,16-18H2,1-4H3/t21-/m1/s1