(6-chloranylpyridin-3-yl)methyl 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate Openeye Name: (6-chloro-3-pyridyl)methyl 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate CAS Name: 1-(4-fluorophenyl)-3-(3-methoxyphenyl)-4-pyrazolecarboxylic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylate Traditional Name: 1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxylic acid (6-chloro-3-pyridyl)methyl ester Formula: C23H17ClFN3O3 MolecularWeight: 437.850783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)OCC3=CN=C(C=C3)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)OCC3=CN=C(C=C3)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H17ClFN3O3/c1-30-19-4-2-3-16(11-19)22-20(13-28(27-22)18-8-6-17(25)7-9-18)23(29)31-14-15-5-10-21(24)26-12-15/h2-13H,14H2,1H3