[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl] methanesulfonate

Systemtic Name: [5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl] methanesulfonate Openeye Name: [5-tert-butyl-2-(p-tolyl)pyrazol-3-yl] methanesulfonate CAS Name: methanesulfonic acid [5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl] ester IUPAC Name: [5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [5-tert-butyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)OS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)OS(=O)(=O)C

InChI

InChI=1S/C15H20N2O3S/c1-11-6-8-12(9-7-11)17-14(20-21(5,18)19)10-13(16-17)15(2,3)4/h6-10H,1-5H3