[4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 1-(4-chlorophenyl)sulfonylcyclopropane-1-carboxylate

Systemtic Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 1-(4-chlorophenyl)sulfonylcyclopropane-1-carboxylate Openeye Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 1-(4-chlorophenyl)sulfonylcyclopropanecarboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-1-cyclopropanecarboxylic acid [4-(3,5-dimethyl-1-pyrazolyl)phenyl]methyl ester IUPAC Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 1-(4-chlorophenyl)sulfonylcyclopropane-1-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylcyclopropanecarboxylic acid [4-(3,5-dimethylpyrazol-1-yl)benzyl] ester Formula: C22H21ClN2O4S MolecularWeight: 444.93114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)COC(=O)C3(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)COC(=O)C3(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C22H21ClN2O4S/c1-15-13-16(2)25(24-15)19-7-3-17(4-8-19)14-29-21(26)22(11-12-22)30(27,28)20-9-5-18(23)6-10-20/h3-10,13H,11-12,14H2,1-2H3