(3-fluoranyl-4-methoxy-phenyl)methyl (3S)-5-oxidanylidene-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl (3S)-5-oxidanylidene-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl (3S)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-[(1R)-1-phenylethyl]-3-pyrrolidinecarboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl (3S)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C21H22FNO4 MolecularWeight: 371.402083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CC(CC2=O)C(=O)OCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2C[C@H](CC2=O)C(=O)OCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C21H22FNO4/c1-14(16-6-4-3-5-7-16)23-12-17(11-20(23)24)21(25)27-13-15-8-9-19(26-2)18(22)10-15/h3-10,14,17H,11-13H2,1-2H3/t14-,17+/m1/s1