[2-(3-methylphenyl)-5-propan-2-yl-pyrazol-3-yl] ethanesulfonate

Systemtic Name: [2-(3-methylphenyl)-5-propan-2-yl-pyrazol-3-yl] ethanesulfonate Openeye Name: [5-isopropyl-2-(m-tolyl)pyrazol-3-yl] ethanesulfonate CAS Name: ethanesulfonic acid [2-(3-methylphenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(3-methylphenyl)-5-propan-2-ylpyrazol-3-yl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-isopropyl-2-(m-tolyl)pyrazol-3-yl] ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC(=NN1C2=CC=CC(=C2)C)C(C)C

Isomeric SMILES

CCS(=O)(=O)OC1=CC(=NN1C2=CC=CC(=C2)C)C(C)C

InChI

InChI=1S/C15H20N2O3S/c1-5-21(18,19)20-15-10-14(11(2)3)16-17(15)13-8-6-7-12(4)9-13/h6-11H,5H2,1-4H3