ethyl 6-(4-methoxycarbonylphenyl)-4-oxidanyl-2-oxidanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate

Systemtic Name: ethyl 6-(4-methoxycarbonylphenyl)-4-oxidanyl-2-oxidanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate Openeye Name: ethyl 4-hydroxy-6-(4-methoxycarbonylphenyl)-2-oxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate CAS Name: 4-hydroxy-6-(4-methoxycarbonylphenyl)-2-oxo-4-(trifluoromethyl)-1,3-diazinane-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-6-(4-methoxycarbonylphenyl)-2-oxo-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate Traditional Name: 6-(4-carbomethoxyphenyl)-4-hydroxy-2-keto-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylic acid ethyl ester Formula: C16H17F3N2O6 MolecularWeight: 390.31119

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(NC(=O)NC1(C(F)(F)F)O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCOC(=O)C1C(NC(=O)NC1(C(F)(F)F)O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C16H17F3N2O6/c1-3-27-13(23)10-11(8-4-6-9(7-5-8)12(22)26-2)20-14(24)21-15(10,25)16(17,18)19/h4-7,10-11,25H,3H2,1-2H3,(H2,20,21,24)