[2-tert-butyl-5-methyl-4-(phenylsulfonyl)pyrazol-3-yl] 2-(2-chloranylphenoxy)ethanoate

Systemtic Name: [2-tert-butyl-5-methyl-4-(phenylsulfonyl)pyrazol-3-yl] 2-(2-chloranylphenoxy)ethanoate Openeye Name: [4-(benzenesulfonyl)-2-tert-butyl-5-methyl-pyrazol-3-yl] 2-(2-chlorophenoxy)acetate CAS Name: 2-(2-chlorophenoxy)acetic acid [4-(benzenesulfonyl)-2-tert-butyl-5-methyl-3-pyrazolyl] ester IUPAC Name: [4-(benzenesulfonyl)-2-tert-butyl-5-methylpyrazol-3-yl] 2-(2-chlorophenoxy)acetate Traditional Name: 2-(2-chlorophenoxy)acetic acid (4-besyl-2-tert-butyl-5-methyl-pyrazol-3-yl) ester Formula: C22H23ClN2O5S MolecularWeight: 462.94642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)C2=CC=CC=C2)OC(=O)COC3=CC=CC=C3Cl)C(C)(C)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)C2=CC=CC=C2)OC(=O)COC3=CC=CC=C3Cl)C(C)(C)C

InChI

InChI=1S/C22H23ClN2O5S/c1-15-20(31(27,28)16-10-6-5-7-11-16)21(25(24-15)22(2,3)4)30-19(26)14-29-18-13-9-8-12-17(18)23/h5-13H,14H2,1-4H3