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

Systemtic Name: methyl (4S)-2-morpholin-4-yl-6-phenyl-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylate Openeye Name: methyl (4S)-2-morpholino-6-phenyl-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylate CAS Name: (4S)-2-(4-morpholinyl)-6-phenyl-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylic acid methyl ester IUPAC Name: methyl (4S)-2-morpholin-4-yl-6-phenyl-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylate Traditional Name: (4S)-2-morpholino-6-phenyl-4-(trifluoromethyl)-1,3,5-oxadiazine-4-carboxylic acid methyl ester Formula: C16H16F3N3O4 MolecularWeight: 371.31115

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(N=C(OC(=N1)N2CCOCC2)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

COC(=O)[C@@]1(N=C(OC(=N1)N2CCOCC2)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C16H16F3N3O4/c1-24-13(23)15(16(17,18)19)20-12(11-5-3-2-4-6-11)26-14(21-15)22-7-9-25-10-8-22/h2-6H,7-10H2,1H3/t15-/m0/s1