methyl 4-phenyl-2-(trichloromethyl)pyrimidine-5-carboxylate

Systemtic Name: methyl 4-phenyl-2-(trichloromethyl)pyrimidine-5-carboxylate Openeye Name: methyl 4-phenyl-2-(trichloromethyl)pyrimidine-5-carboxylate CAS Name: 4-phenyl-2-(trichloromethyl)-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-phenyl-2-(trichloromethyl)pyrimidine-5-carboxylate Traditional Name: 4-phenyl-2-(trichloromethyl)pyrimidine-5-carboxylic acid methyl ester Formula: C13H9Cl3N2O2 MolecularWeight: 331.58176

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(N=C1C2=CC=CC=C2)C(Cl)(Cl)Cl

Isomeric SMILES

COC(=O)C1=CN=C(N=C1C2=CC=CC=C2)C(Cl)(Cl)Cl

InChI

InChI=1S/C13H9Cl3N2O2/c1-20-11(19)9-7-17-12(13(14,15)16)18-10(9)8-5-3-2-4-6-8/h2-7H,1H3