ethyl 1-[[1-[(2-fluorophenyl)methyl]-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[1-[(2-fluorophenyl)methyl]-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[1-[(2-fluorophenyl)methyl]-3-hydroxy-2-oxo-3-piperidyl]methyl]piperidine-4-carboxylate CAS Name: 1-[[1-[(2-fluorophenyl)methyl]-3-hydroxy-2-oxo-3-piperidinyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[1-[(2-fluorophenyl)methyl]-3-hydroxy-2-oxopiperidin-3-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[[1-(2-fluorobenzyl)-3-hydroxy-2-keto-3-piperidyl]methyl]isonipecotic acid ethyl ester Formula: C21H29FN2O4 MolecularWeight: 392.464363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC2(CCCN(C2=O)CC3=CC=CC=C3F)O

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC2(CCCN(C2=O)CC3=CC=CC=C3F)O

InChI

InChI=1S/C21H29FN2O4/c1-2-28-19(25)16-8-12-23(13-9-16)15-21(27)10-5-11-24(20(21)26)14-17-6-3-4-7-18(17)22/h3-4,6-7,16,27H,2,5,8-15H2,1H3