[(3S)-4,4-dimethyl-2-oxidanylidene-1-phenyl-pyrrolidin-3-yl] (2S)-2-phenylbutanoate

Systemtic Name: [(3S)-4,4-dimethyl-2-oxidanylidene-1-phenyl-pyrrolidin-3-yl] (2S)-2-phenylbutanoate Openeye Name: [(3S)-4,4-dimethyl-2-oxo-1-phenyl-pyrrolidin-3-yl] (2S)-2-phenylbutanoate CAS Name: (2S)-2-phenylbutanoic acid [(3S)-4,4-dimethyl-2-oxo-1-phenyl-3-pyrrolidinyl] ester IUPAC Name: [(3S)-4,4-dimethyl-2-oxo-1-phenylpyrrolidin-3-yl] (2S)-2-phenylbutanoate Traditional Name: (2S)-2-phenylbutyric acid [(3S)-2-keto-4,4-dimethyl-1-phenyl-pyrrolidin-3-yl] ester Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OC2C(=O)N(CC2(C)C)C3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)C(=O)O[C@@H]2C(=O)N(CC2(C)C)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO3/c1-4-18(16-11-7-5-8-12-16)21(25)26-19-20(24)23(15-22(19,2)3)17-13-9-6-10-14-17/h5-14,18-19H,4,15H2,1-3H3/t18-,19+/m0/s1