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4-cyano-2-(2-methoxyphenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid

4-cyano-2-(2-methoxyphenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid

Systemtic Name:4-cyano-2-(2-methoxyphenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid
Openeye Name:4-cyano-2-(2-methoxyphenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid
CAS Name:4-cyano-2-(2-methoxyphenyl)-5-(trifluoromethyl)-3-pyrazolecarboxylic acid
IUPAC Name:4-cyano-2-(2-methoxyphenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid
Traditional Name:4-cyano-2-(2-methoxyphenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid
Formula: C13H8F3N3O3
MolecularWeight: 311.21613
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=C(C(=N2)C(F)(F)F)C#N)C(=O)O


Isomeric SMILES

COC1=CC=CC=C1N2C(=C(C(=N2)C(F)(F)F)C#N)C(=O)O


InChI

InChI=1S/C13H8F3N3O3/c1-22-9-5-3-2-4-8(9)19-10(12(20)21)7(6-17)11(18-19)13(14,15)16/h2-5H,1H3,(H,20,21)


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