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

Systemtic Name: propyl (2S)-1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-3,3-diphenyl-pyrrolidine-2-carboxylate Openeye Name: propyl (2S)-1-(3,3-dimethyl-2-oxo-pentanoyl)-3,3-diphenyl-pyrrolidine-2-carboxylate CAS Name: (2S)-1-(3,3-dimethyl-1,2-dioxopentyl)-3,3-diphenyl-2-pyrrolidinecarboxylic acid propyl ester IUPAC Name: propyl (2S)-1-(3,3-dimethyl-2-oxopentanoyl)-3,3-diphenylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-keto-3,3-dimethyl-pentanoyl)-3,3-diphenyl-pyrrolidine-2-carboxylic acid propyl ester Formula: C27H33NO4 MolecularWeight: 435.55522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33NO4/c1-5-19-32-25(31)22-27(20-13-9-7-10-14-20,21-15-11-8-12-16-21)17-18-28(22)24(30)23(29)26(3,4)6-2/h7-16,22H,5-6,17-19H2,1-4H3/t22-/m1/s1