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

Systemtic Name: propyl (2S)-1-(3,3-dimethyl-2-oxidanylidene-butanoyl)-3-pyridin-3-yl-pyrrolidine-2-carboxylate Openeye Name: propyl (2S)-1-(3,3-dimethyl-2-oxo-butanoyl)-3-(3-pyridyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(3,3-dimethyl-1,2-dioxobutyl)-3-(3-pyridinyl)-2-pyrrolidinecarboxylic acid propyl ester IUPAC Name: propyl (2S)-1-(3,3-dimethyl-2-oxobutanoyl)-3-pyridin-3-ylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-keto-3,3-dimethyl-butanoyl)-3-(3-pyridyl)pyrrolidine-2-carboxylic acid propyl ester Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O4/c1-5-11-25-18(24)15-14(13-7-6-9-20-12-13)8-10-21(15)17(23)16(22)19(2,3)4/h6-7,9,12,14-15H,5,8,10-11H2,1-4H3/t14?,15-/m0/s1