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

Systemtic Name: [2-[(3-chlorophenyl)methyl]-5-methyl-pyrazol-3-yl] 3-methylbenzenesulfonate Openeye Name: [2-[(3-chlorophenyl)methyl]-5-methyl-pyrazol-3-yl] 3-methylbenzenesulfonate CAS Name: 3-methylbenzenesulfonic acid [2-[(3-chlorophenyl)methyl]-5-methyl-3-pyrazolyl] ester IUPAC Name: [2-[(3-chlorophenyl)methyl]-5-methylpyrazol-3-yl] 3-methylbenzenesulfonate Traditional Name: 3-methylbenzenesulfonic acid [2-(3-chlorobenzyl)-5-methyl-pyrazol-3-yl] ester Formula: C18H17ClN2O3S MolecularWeight: 376.85718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)OC2=CC(=NN2CC3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)OC2=CC(=NN2CC3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C18H17ClN2O3S/c1-13-5-3-8-17(9-13)25(22,23)24-18-10-14(2)20-21(18)12-15-6-4-7-16(19)11-15/h3-11H,12H2,1-2H3