ethyl (3S)-1-ethanoyl-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-ethanoyl-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-acetyl-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate CAS Name: (3S)-1-acetyl-3-[(4-fluorophenyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-acetyl-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate Traditional Name: (3S)-1-acetyl-3-(4-fluorobenzyl)nipecotic acid ethyl ester Formula: C17H22FNO3 MolecularWeight: 307.359883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C)CC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)[C@@]1(CCCN(C1)C(=O)C)CC2=CC=C(C=C2)F

InChI

InChI=1S/C17H22FNO3/c1-3-22-16(21)17(9-4-10-19(12-17)13(2)20)11-14-5-7-15(18)8-6-14/h5-8H,3-4,9-12H2,1-2H3/t17-/m0/s1