ethyl (2S)-4,4-dimethyl-5-oxidanylidene-1-(3-phenylprop-2-ynoyl)pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S)-4,4-dimethyl-5-oxidanylidene-1-(3-phenylprop-2-ynoyl)pyrrolidine-2-carboxylate Openeye Name: ethyl (2S)-4,4-dimethyl-5-oxo-1-(3-phenylprop-2-ynoyl)pyrrolidine-2-carboxylate CAS Name: (2S)-4,4-dimethyl-5-oxo-1-(1-oxo-3-phenylprop-2-ynyl)-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S)-4,4-dimethyl-5-oxo-1-(3-phenylprop-2-ynoyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-5-keto-4,4-dimethyl-1-(3-phenylpropioloyl)pyrrolidine-2-carboxylic acid ethyl ester Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(C(=O)N1C(=O)C#CC2=CC=CC=C2)(C)C

Isomeric SMILES

CCOC(=O)[C@@H]1CC(C(=O)N1C(=O)C#CC2=CC=CC=C2)(C)C

InChI

InChI=1S/C18H19NO4/c1-4-23-16(21)14-12-18(2,3)17(22)19(14)15(20)11-10-13-8-6-5-7-9-13/h5-9,14H,4,12H2,1-3H3/t14-/m0/s1