ethyl (2S)-1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-3-(3,4,5-trimethoxyphenyl)pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S)-1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-3-(3,4,5-trimethoxyphenyl)pyrrolidine-2-carboxylate Openeye Name: ethyl (2S)-1-(3,3-dimethyl-2-oxo-pentanoyl)-3-(3,4,5-trimethoxyphenyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(3,3-dimethyl-1,2-dioxopentyl)-3-(3,4,5-trimethoxyphenyl)-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S)-1-(3,3-dimethyl-2-oxopentanoyl)-3-(3,4,5-trimethoxyphenyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-keto-3,3-dimethyl-pentanoyl)-3-(3,4,5-trimethoxyphenyl)pyrrolidine-2-carboxylic acid ethyl ester Formula: C23H33NO7 MolecularWeight: 435.51062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCC(C1C(=O)OCC)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CCC([C@H]1C(=O)OCC)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C23H33NO7/c1-8-23(3,4)20(25)21(26)24-11-10-15(18(24)22(27)31-9-2)14-12-16(28-5)19(30-7)17(13-14)29-6/h12-13,15,18H,8-11H2,1-7H3/t15?,18-/m0/s1