(4-methanoylphenyl) (3S)-1-(2,6-diethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-methanoylphenyl) (3S)-1-(2,6-diethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-formylphenyl) (3S)-1-(2,6-diethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2,6-diethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-formylphenyl) ester IUPAC Name: (4-formylphenyl) (3S)-1-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2,6-diethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid (4-formylphenyl) ester Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2CC(CC2=O)C(=O)OC3=CC=C(C=C3)C=O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2C[C@H](CC2=O)C(=O)OC3=CC=C(C=C3)C=O

InChI

InChI=1S/C22H23NO4/c1-3-16-6-5-7-17(4-2)21(16)23-13-18(12-20(23)25)22(26)27-19-10-8-15(14-24)9-11-19/h5-11,14,18H,3-4,12-13H2,1-2H3/t18-/m0/s1