ethyl 2-(3-chloranylpyridin-2-yl)-5-(4-methylphenyl)sulfonyloxy-3,4-dihydropyrazole-3-carboxylate

Systemtic Name: ethyl 2-(3-chloranylpyridin-2-yl)-5-(4-methylphenyl)sulfonyloxy-3,4-dihydropyrazole-3-carboxylate Openeye Name: ethyl 2-(3-chloro-2-pyridyl)-5-(p-tolylsulfonyloxy)-3,4-dihydropyrazole-3-carboxylate CAS Name: 2-(3-chloro-2-pyridinyl)-5-(4-methylphenyl)sulfonyloxy-3,4-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-chloropyridin-2-yl)-5-(4-methylphenyl)sulfonyloxy-3,4-dihydropyrazole-3-carboxylate Traditional Name: 2-(3-chloro-2-pyridyl)-5-tosyloxy-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C18H18ClN3O5S MolecularWeight: 423.87062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(=NN1C2=C(C=CC=N2)Cl)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CC(=NN1C2=C(C=CC=N2)Cl)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C18H18ClN3O5S/c1-3-26-18(23)15-11-16(21-22(15)17-14(19)5-4-10-20-17)27-28(24,25)13-8-6-12(2)7-9-13/h4-10,15H,3,11H2,1-2H3