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

Systemtic Name: ethyl 2-[2-(4-nitrophenyl)sulfonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-(4-nitrophenyl)sulfonylhydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[(4-nitrophenyl)sulfonylhydrazo]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-nitrophenyl)sulfonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-(N'-nosylhydrazino)-4-(trifluoromethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C14H12F3N5O6S MolecularWeight: 435.33519

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12F3N5O6S/c1-2-28-12(23)10-7-18-13(19-11(10)14(15,16)17)20-21-29(26,27)9-5-3-8(4-6-9)22(24)25/h3-7,21H,2H2,1H3,(H,18,19,20)