methyl 2-morpholin-4-yl-6-(3-nitrophenyl)-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylate

Systemtic Name: methyl 2-morpholin-4-yl-6-(3-nitrophenyl)-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylate Openeye Name: methyl 2-morpholino-6-(3-nitrophenyl)-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylate CAS Name: 2-(4-morpholinyl)-6-(3-nitrophenyl)-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylic acid methyl ester IUPAC Name: methyl 2-morpholin-4-yl-6-(3-nitrophenyl)-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylate Traditional Name: 2-morpholino-6-(3-nitrophenyl)-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylic acid methyl ester Formula: C16H15F3N4O6 MolecularWeight: 416.30871

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(N=C(OC(=N1)N2CCOCC2)C3=CC(=CC=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

COC(=O)C1(N=C(OC(=N1)N2CCOCC2)C3=CC(=CC=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C16H15F3N4O6/c1-27-13(24)15(16(17,18)19)20-12(10-3-2-4-11(9-10)23(25)26)29-14(21-15)22-5-7-28-8-6-22/h2-4,9H,5-8H2,1H3