(4-ethoxy-3-methoxy-phenyl)methyl (3S)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxylate

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl (3S)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxylate Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl (3S)-5-oxo-1-phenethyl-pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-phenethyl-3-pyrrolidinecarboxylic acid (4-ethoxy-3-methoxyphenyl)methyl ester IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl (3S)-5-oxo-1-phenethylpyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-phenethyl-pyrrolidine-3-carboxylic acid (4-ethoxy-3-methoxy-benzyl) ester Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)COC(=O)C2CC(=O)N(C2)CCC3=CC=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)COC(=O)[C@H]2CC(=O)N(C2)CCC3=CC=CC=C3)OC

InChI

InChI=1S/C23H27NO5/c1-3-28-20-10-9-18(13-21(20)27-2)16-29-23(26)19-14-22(25)24(15-19)12-11-17-7-5-4-6-8-17/h4-10,13,19H,3,11-12,14-16H2,1-2H3/t19-/m0/s1