2-[5-cyclopropyl-4-(3,5-dicyanophenoxy)-3-(trifluoromethyl)pyrazol-1-yl]ethyl methanesulfonate

Systemtic Name: 2-[5-cyclopropyl-4-(3,5-dicyanophenoxy)-3-(trifluoromethyl)pyrazol-1-yl]ethyl methanesulfonate Openeye Name: 2-[5-cyclopropyl-4-(3,5-dicyanophenoxy)-3-(trifluoromethyl)pyrazol-1-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[5-cyclopropyl-4-(3,5-dicyanophenoxy)-3-(trifluoromethyl)-1-pyrazolyl]ethyl ester IUPAC Name: 2-[5-cyclopropyl-4-(3,5-dicyanophenoxy)-3-(trifluoromethyl)pyrazol-1-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[5-cyclopropyl-4-(3,5-dicyanophenoxy)-3-(trifluoromethyl)pyrazol-1-yl]ethyl ester Formula: C18H15F3N4O4S MolecularWeight: 440.39631

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCN1C(=C(C(=N1)C(F)(F)F)OC2=CC(=CC(=C2)C#N)C#N)C3CC3

Isomeric SMILES

CS(=O)(=O)OCCN1C(=C(C(=N1)C(F)(F)F)OC2=CC(=CC(=C2)C#N)C#N)C3CC3

InChI

InChI=1S/C18H15F3N4O4S/c1-30(26,27)28-5-4-25-15(13-2-3-13)16(17(24-25)18(19,20)21)29-14-7-11(9-22)6-12(8-14)10-23/h6-8,13H,2-5H2,1H3