methyl 2-[2-(4-nitrophenyl)carbonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: methyl 2-[2-(4-nitrophenyl)carbonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: methyl 2-[2-(4-nitrobenzoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[[(4-nitrophenyl)-oxomethyl]hydrazo]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(4-nitrobenzoyl)hydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-[N'-(4-nitrobenzoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid methyl ester Formula: C14H10F3N5O5 MolecularWeight: 385.25491

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(N=C1C(F)(F)F)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CN=C(N=C1C(F)(F)F)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H10F3N5O5/c1-27-12(24)9-6-18-13(19-10(9)14(15,16)17)21-20-11(23)7-2-4-8(5-3-7)22(25)26/h2-6H,1H3,(H,20,23)(H,18,19,21)