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

Systemtic Name: ethyl 2-[2-(4-nitrophenyl)carbonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-(4-nitrobenzoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[[(4-nitrophenyl)-oxomethyl]hydrazo]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-nitrobenzoyl)hydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-[N'-(4-nitrobenzoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C15H12F3N5O5 MolecularWeight: 399.28149

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12F3N5O5/c1-2-28-13(25)10-7-19-14(20-11(10)15(16,17)18)22-21-12(24)8-3-5-9(6-4-8)23(26)27/h3-7H,2H2,1H3,(H,21,24)(H,19,20,22)