(4-ethylphenyl) (3S)-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-ethylphenyl) (3S)-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-ethylphenyl) (3S)-1-(3,4-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) (3S)-1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3,4-dimethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid (4-ethylphenyl) ester Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)OC(=O)[C@H]2CC(=O)N(C2)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C21H23NO3/c1-4-16-6-9-19(10-7-16)25-21(24)17-12-20(23)22(13-17)18-8-5-14(2)15(3)11-18/h5-11,17H,4,12-13H2,1-3H3/t17-/m0/s1