ethyl 4-[(4-methoxyphenyl)methyl]-1-[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonyl-piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(4-methoxyphenyl)methyl]-1-[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonyl-piperidine-4-carboxylate Openeye Name: ethyl 4-[(4-methoxyphenyl)methyl]-1-[(2S)-5-oxopyrrolidine-2-carbonyl]piperidine-4-carboxylate CAS Name: 4-[(4-methoxyphenyl)methyl]-1-[oxo-[(2S)-5-oxo-2-pyrrolidinyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-methoxyphenyl)methyl]-1-[(2S)-5-oxopyrrolidine-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[(2S)-5-ketoprolyl]-4-p-anisyl-isonipecotic acid ethyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2CCC(=O)N2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)[C@@H]2CCC(=O)N2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H28N2O5/c1-3-28-20(26)21(14-15-4-6-16(27-2)7-5-15)10-12-23(13-11-21)19(25)17-8-9-18(24)22-17/h4-7,17H,3,8-14H2,1-2H3,(H,22,24)/t17-/m0/s1