propyl (2S)-1-(2-cyclohexyl-2-oxidanylidene-ethanoyl)-3-pyridin-3-yl-pyrrolidine-2-carboxylate

Systemtic Name: propyl (2S)-1-(2-cyclohexyl-2-oxidanylidene-ethanoyl)-3-pyridin-3-yl-pyrrolidine-2-carboxylate Openeye Name: propyl (2S)-1-(2-cyclohexyl-2-oxo-acetyl)-3-(3-pyridyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(2-cyclohexyl-1,2-dioxoethyl)-3-(3-pyridinyl)-2-pyrrolidinecarboxylic acid propyl ester IUPAC Name: propyl (2S)-1-(2-cyclohexyl-2-oxoacetyl)-3-pyridin-3-ylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-cyclohexyl-2-keto-acetyl)-3-(3-pyridyl)pyrrolidine-2-carboxylic acid propyl ester Formula: C21H28N2O4 MolecularWeight: 372.45802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1C(CCN1C(=O)C(=O)C2CCCCC2)C3=CN=CC=C3

Isomeric SMILES

CCCOC(=O)[C@@H]1C(CCN1C(=O)C(=O)C2CCCCC2)C3=CN=CC=C3

InChI

InChI=1S/C21H28N2O4/c1-2-13-27-21(26)18-17(16-9-6-11-22-14-16)10-12-23(18)20(25)19(24)15-7-4-3-5-8-15/h6,9,11,14-15,17-18H,2-5,7-8,10,12-13H2,1H3/t17?,18-/m0/s1