ethyl 2-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-(4-chloro-2,5-dimethoxy-anilino)-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-(4-chloro-2,5-dimethoxyanilino)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chloro-2,5-dimethoxyanilino)-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-(4-chloro-2,5-dimethoxy-anilino)-4-(trifluoromethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H15ClF3N3O4 MolecularWeight: 405.75621

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)NC2=CC(=C(C=C2OC)Cl)OC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)NC2=CC(=C(C=C2OC)Cl)OC

InChI

InChI=1S/C16H15ClF3N3O4/c1-4-27-14(24)8-7-21-15(23-13(8)16(18,19)20)22-10-6-11(25-2)9(17)5-12(10)26-3/h5-7H,4H2,1-3H3,(H,21,22,23)