methyl 2-[[5-(4-fluorophenyl)-3-oxidanylidene-1,2-oxazol-2-yl]methyl]-3-morpholin-4-yl-propaneperoxoate

Systemtic Name: methyl 2-[[5-(4-fluorophenyl)-3-oxidanylidene-1,2-oxazol-2-yl]methyl]-3-morpholin-4-yl-propaneperoxoate Openeye Name: methyl 2-[[5-(4-fluorophenyl)-3-oxo-isoxazol-2-yl]methyl]-3-morpholino-propaneperoxoate CAS Name: 2-[[5-(4-fluorophenyl)-3-oxo-2-isoxazolyl]methyl]-3-(4-morpholinyl)propaneperoxoic acid methyl ester IUPAC Name: methyl 2-[[5-(4-fluorophenyl)-3-oxo-1,2-oxazol-2-yl]methyl]-3-morpholin-4-ylpropaneperoxoate Traditional Name: 2-[[5-(4-fluorophenyl)-3-keto-4-isoxazolin-2-yl]methyl]-3-morpholino-peroxypropionic acid methyl ester Formula: C18H21FN2O6 MolecularWeight: 380.367543

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Descriptors Computed from Structure

Canonical SMILES:

COOC(=O)C(CN1CCOCC1)CN2C(=O)C=C(O2)C3=CC=C(C=C3)F

Isomeric SMILES

COOC(=O)C(CN1CCOCC1)CN2C(=O)C=C(O2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H21FN2O6/c1-24-27-18(23)14(11-20-6-8-25-9-7-20)12-21-17(22)10-16(26-21)13-2-4-15(19)5-3-13/h2-5,10,14H,6-9,11-12H2,1H3