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

Systemtic Name: (2,6-dimethylphenyl) (3S)-1-(2,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (2,6-dimethylphenyl) (3S)-1-(2,4-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2,4-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) (3S)-1-(2,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2,4-dimethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid (2,6-dimethylphenyl) ester Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CC(CC2=O)C(=O)OC3=C(C=CC=C3C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C[C@H](CC2=O)C(=O)OC3=C(C=CC=C3C)C)C

InChI

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