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

Systemtic Name: (4-ethylphenyl) (3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-ethylphenyl) (3S)-1-(4-ethoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) (3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-p-phenetyl-pyrrolidine-3-carboxylic acid (4-ethylphenyl) ester Formula: C21H23NO4 MolecularWeight: 353.41162

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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)OCC

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO4/c1-3-15-5-9-19(10-6-15)26-21(24)16-13-20(23)22(14-16)17-7-11-18(12-8-17)25-4-2/h5-12,16H,3-4,13-14H2,1-2H3/t16-/m0/s1