[2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methylbenzenesulfonate Openeye Name: [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-methyl-5-(trifluoromethyl)-3-pyrazolyl] ester IUPAC Name: [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] ester Formula: C12H11F3N2O3S MolecularWeight: 320.28755

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=NN2C)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=NN2C)C(F)(F)F

InChI

InChI=1S/C12H11F3N2O3S/c1-8-3-5-9(6-4-8)21(18,19)20-11-7-10(12(13,14)15)16-17(11)2/h3-7H,1-2H3