(4-ethanoylphenyl) (3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-ethanoylphenyl) (3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-acetylphenyl) (3S)-1-(4-ethoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) (3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-p-phenetyl-pyrrolidine-3-carboxylic acid (4-acetylphenyl) ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)OC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H21NO5/c1-3-26-18-10-6-17(7-11-18)22-13-16(12-20(22)24)21(25)27-19-8-4-15(5-9-19)14(2)23/h4-11,16H,3,12-13H2,1-2H3/t16-/m0/s1