(4-ethylphenyl) (3S)-5-oxidanylidene-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate

Systemtic Name: (4-ethylphenyl) (3S)-5-oxidanylidene-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate Openeye Name: (4-ethylphenyl) (3S)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-[(1R)-1-phenylethyl]-3-pyrrolidinecarboxylic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) (3S)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-[(1R)-1-phenylethyl]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)C(C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO3/c1-3-16-9-11-19(12-10-16)25-21(24)18-13-20(23)22(14-18)15(2)17-7-5-4-6-8-17/h4-12,15,18H,3,13-14H2,1-2H3/t15-,18+/m1/s1