ethyl 1-[3-[(2-methyl-5-nitro-pyridin-3-yl)carbonylamino]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[3-[(2-methyl-5-nitro-pyridin-3-yl)carbonylamino]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-[3-[(2-methyl-5-nitro-pyridine-3-carbonyl)amino]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-[3-[[(2-methyl-5-nitro-3-pyridinyl)-oxomethyl]amino]phenyl]-5-(trifluoromethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(2-methyl-5-nitropyridine-3-carbonyl)amino]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-[3-[(2-methyl-5-nitro-nicotinoyl)amino]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylic acid ethyl ester Formula: C20H16F3N5O5 MolecularWeight: 463.36675

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)C3=CC(=CN=C3C)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)C3=CC(=CN=C3C)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C20H16F3N5O5/c1-3-33-19(30)16-10-25-27(17(16)20(21,22)23)13-6-4-5-12(7-13)26-18(29)15-8-14(28(31)32)9-24-11(15)2/h4-10H,3H2,1-2H3,(H,26,29)