ethyl (3S)-1-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[[3-(4-fluorophenyl)-1,2-oxazol-5-yl]carbonyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[3-(4-fluorophenyl)isoxazole-5-carbonyl]piperidine-3-carboxylate CAS Name: (3S)-1-[[3-(4-fluorophenyl)-5-isoxazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[3-(4-fluorophenyl)-1,2-oxazole-5-carbonyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[3-(4-fluorophenyl)isoxazole-5-carbonyl]nipecotic acid ethyl ester Formula: C18H19FN2O4 MolecularWeight: 346.352863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NO2)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)C2=CC(=NO2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H19FN2O4/c1-2-24-18(23)13-4-3-9-21(11-13)17(22)16-10-15(20-25-16)12-5-7-14(19)8-6-12/h5-8,10,13H,2-4,9,11H2,1H3/t13-/m0/s1