ethyl 6-[4-(diethylamino)phenyl]-4-oxidanyl-2-oxidanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate

Systemtic Name: ethyl 6-[4-(diethylamino)phenyl]-4-oxidanyl-2-oxidanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate Openeye Name: ethyl 6-[4-(diethylamino)phenyl]-4-hydroxy-2-oxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate CAS Name: 6-[4-(diethylamino)phenyl]-4-hydroxy-2-oxo-4-(trifluoromethyl)-1,3-diazinane-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-(diethylamino)phenyl]-4-hydroxy-2-oxo-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate Traditional Name: 6-[4-(diethylamino)phenyl]-4-hydroxy-2-keto-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylic acid ethyl ester Formula: C18H24F3N3O4 MolecularWeight: 403.39607

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2C(C(NC(=O)N2)(C(F)(F)F)O)C(=O)OCC

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2C(C(NC(=O)N2)(C(F)(F)F)O)C(=O)OCC

InChI

InChI=1S/C18H24F3N3O4/c1-4-24(5-2)12-9-7-11(8-10-12)14-13(15(25)28-6-3)17(27,18(19,20)21)23-16(26)22-14/h7-10,13-14,27H,4-6H2,1-3H3,(H2,22,23,26)