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

Systemtic Name: (2,6-dimethylphenyl) (3S)-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate Openeye Name: (2,6-dimethylphenyl) (3S)-1-benzyl-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) (3S)-1-benzyl-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-benzyl-5-keto-pyrrolidine-3-carboxylic acid (2,6-dimethylphenyl) ester Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)C2CC(=O)N(C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)[C@H]2CC(=O)N(C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H21NO3/c1-14-7-6-8-15(2)19(14)24-20(23)17-11-18(22)21(13-17)12-16-9-4-3-5-10-16/h3-10,17H,11-13H2,1-2H3/t17-/m0/s1