ethyl 3-[[4-(4-fluorophenyl)-5-oxidanylidene-3-pyridin-4-yl-1,2-oxazol-2-yl]carbonylamino]propanoate

Systemtic Name: ethyl 3-[[4-(4-fluorophenyl)-5-oxidanylidene-3-pyridin-4-yl-1,2-oxazol-2-yl]carbonylamino]propanoate Openeye Name: ethyl 3-[[4-(4-fluorophenyl)-5-oxo-3-(4-pyridyl)isoxazole-2-carbonyl]amino]propanoate CAS Name: 3-[[[4-(4-fluorophenyl)-5-oxo-3-pyridin-4-yl-2-isoxazolyl]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(4-fluorophenyl)-5-oxo-3-pyridin-4-yl-1,2-oxazole-2-carbonyl]amino]propanoate Traditional Name: 3-[[4-(4-fluorophenyl)-5-keto-3-(4-pyridyl)-3-isoxazoline-2-carbonyl]amino]propionic acid ethyl ester Formula: C20H18FN3O5 MolecularWeight: 399.372423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)N1C(=C(C(=O)O1)C2=CC=C(C=C2)F)C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)CCNC(=O)N1C(=C(C(=O)O1)C2=CC=C(C=C2)F)C3=CC=NC=C3

InChI

InChI=1S/C20H18FN3O5/c1-2-28-16(25)9-12-23-20(27)24-18(14-7-10-22-11-8-14)17(19(26)29-24)13-3-5-15(21)6-4-13/h3-8,10-11H,2,9,12H2,1H3,(H,23,27)