methyl 6-methyl-3-nitro-2-oxidanylidene-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 6-methyl-3-nitro-2-oxidanylidene-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-methyl-3-nitro-2-oxo-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidine-5-carboxylate CAS Name: 6-methyl-3-nitro-2-oxo-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-methyl-3-nitro-2-oxo-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-6-methyl-3-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C14H12F3N3O5 MolecularWeight: 359.25739

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC

Isomeric SMILES

CC1=C(C(N(C(=O)N1)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC

InChI

InChI=1S/C14H12F3N3O5/c1-7-10(12(21)25-2)11(19(20(23)24)13(22)18-7)8-5-3-4-6-9(8)14(15,16)17/h3-6,11H,1-2H3,(H,18,22)