methyl 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-5-phenyl-pyrazole-3-carboxylate

Systemtic Name: methyl 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-5-phenyl-pyrazole-3-carboxylate Openeye Name: methyl 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-5-phenyl-pyrazole-3-carboxylate CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-phenyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-5-phenylpyrazole-3-carboxylate Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-5-phenyl-pyrazole-3-carboxylic acid methyl ester Formula: C17H11ClF3N3O2 MolecularWeight: 381.73635

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C(=C1)C2=CC=CC=C2)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

COC(=O)C1=NN(C(=C1)C2=CC=CC=C2)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C17H11ClF3N3O2/c1-26-16(25)13-8-14(10-5-3-2-4-6-10)24(23-13)15-12(18)7-11(9-22-15)17(19,20)21/h2-9H,1H3