[2-(4-chlorophenyl)-5-ethyl-pyrazol-3-yl] ethanesulfonate

Systemtic Name: [2-(4-chlorophenyl)-5-ethyl-pyrazol-3-yl] ethanesulfonate Openeye Name: [2-(4-chlorophenyl)-5-ethyl-pyrazol-3-yl] ethanesulfonate CAS Name: ethanesulfonic acid [2-(4-chlorophenyl)-5-ethyl-3-pyrazolyl] ester IUPAC Name: [2-(4-chlorophenyl)-5-ethylpyrazol-3-yl] ethanesulfonate Traditional Name: ethanesulfonic acid [2-(4-chlorophenyl)-5-ethyl-pyrazol-3-yl] ester Formula: C13H15ClN2O3S MolecularWeight: 314.7878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)OS(=O)(=O)CC)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC1=NN(C(=C1)OS(=O)(=O)CC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H15ClN2O3S/c1-3-11-9-13(19-20(17,18)4-2)16(15-11)12-7-5-10(14)6-8-12/h5-9H,3-4H2,1-2H3