ethyl 3-[(2-fluorophenyl)methyl]-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 3-[(2-fluorophenyl)methyl]-1-[3-(2-oxidanylidenepyrrolidin-1-yl)propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 3-[(2-fluorophenyl)methyl]-1-[3-(2-oxopyrrolidin-1-yl)propanoyl]piperidine-3-carboxylate CAS Name: 3-[(2-fluorophenyl)methyl]-1-[1-oxo-3-(2-oxo-1-pyrrolidinyl)propyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-fluorophenyl)methyl]-1-[3-(2-oxopyrrolidin-1-yl)propanoyl]piperidine-3-carboxylate Traditional Name: 3-(2-fluorobenzyl)-1-[3-(2-ketopyrrolidino)propanoyl]nipecotic acid ethyl ester Formula: C22H29FN2O4 MolecularWeight: 404.475063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)CCN2CCCC2=O)CC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)CCN2CCCC2=O)CC3=CC=CC=C3F

InChI

InChI=1S/C22H29FN2O4/c1-2-29-21(28)22(15-17-7-3-4-8-18(17)23)11-6-13-25(16-22)20(27)10-14-24-12-5-9-19(24)26/h3-4,7-8H,2,5-6,9-16H2,1H3