ethyl 5-azanyl-1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylic acid ethyl ester Formula: C12H10ClF3N4O2 MolecularWeight: 334.68161

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=C(C=C(C=N2)C(F)(F)F)Cl)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=C(C=C(C=N2)C(F)(F)F)Cl)N

InChI

InChI=1S/C12H10ClF3N4O2/c1-2-22-11(21)7-5-19-20(9(7)17)10-8(13)3-6(4-18-10)12(14,15)16/h3-5H,2,17H2,1H3