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

Systemtic Name: ethyl 4-[[3-(3-fluorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[3-(3-fluorophenyl)-4,5-dihydroisoxazole-5-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[3-(3-fluorophenyl)-4,5-dihydroisoxazol-5-yl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(3-fluorophenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[3-(3-fluorophenyl)-2-isoxazoline-5-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C18H22FN3O4 MolecularWeight: 363.383383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2CC(=NO2)C3=CC(=CC=C3)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2CC(=NO2)C3=CC(=CC=C3)F

InChI

InChI=1S/C18H22FN3O4/c1-2-25-18(24)22-8-6-14(7-9-22)20-17(23)16-11-15(21-26-16)12-4-3-5-13(19)10-12/h3-5,10,14,16H,2,6-9,11H2,1H3,(H,20,23)