[5-(methoxymethyl)-2-(4-methylphenyl)pyrazol-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [5-(methoxymethyl)-2-(4-methylphenyl)pyrazol-3-yl] 4-methylbenzenesulfonate Openeye Name: [5-(methoxymethyl)-2-(p-tolyl)pyrazol-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-(methoxymethyl)-2-(4-methylphenyl)-3-pyrazolyl] ester IUPAC Name: [5-(methoxymethyl)-2-(4-methylphenyl)pyrazol-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [5-(methoxymethyl)-2-(p-tolyl)pyrazol-3-yl] ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)COC)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)COC)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H20N2O4S/c1-14-4-8-17(9-5-14)21-19(12-16(20-21)13-24-3)25-26(22,23)18-10-6-15(2)7-11-18/h4-12H,13H2,1-3H3