1H-pyrazol-4-yl 2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)benzoate

Systemtic Name: 1H-pyrazol-4-yl 2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)benzoate Openeye Name: 1H-pyrazol-4-yl 2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)benzoate CAS Name: 2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)benzoic acid 1H-pyrazol-4-yl ester IUPAC Name: 1H-pyrazol-4-yl 2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)benzoate Traditional Name: 2-(4-mesylphenyl)-5-(trifluoromethyl)benzoic acid 1H-pyrazol-4-yl ester Formula: C18H13F3N2O4S MolecularWeight: 410.36703

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C(F)(F)F)C(=O)OC3=CNN=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C(F)(F)F)C(=O)OC3=CNN=C3

InChI

InChI=1S/C18H13F3N2O4S/c1-28(25,26)14-5-2-11(3-6-14)15-7-4-12(18(19,20)21)8-16(15)17(24)27-13-9-22-23-10-13/h2-10H,1H3,(H,22,23)