methyl 3-[3,5-dimethyl-1-[4-(2-methylsulfonyloxyethyl)phenyl]pyrazol-4-yl]benzoate

Systemtic Name: methyl 3-[3,5-dimethyl-1-[4-(2-methylsulfonyloxyethyl)phenyl]pyrazol-4-yl]benzoate Openeye Name: methyl 3-[3,5-dimethyl-1-[4-(2-methylsulfonyloxyethyl)phenyl]pyrazol-4-yl]benzoate CAS Name: 3-[3,5-dimethyl-1-[4-(2-methylsulfonyloxyethyl)phenyl]-4-pyrazolyl]benzoic acid methyl ester IUPAC Name: methyl 3-[3,5-dimethyl-1-[4-(2-methylsulfonyloxyethyl)phenyl]pyrazol-4-yl]benzoate Traditional Name: 3-[3,5-dimethyl-1-[4-(2-methylsulfonyloxyethyl)phenyl]pyrazol-4-yl]benzoic acid methyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)CCOS(=O)(=O)C)C)C3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)CCOS(=O)(=O)C)C)C3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C22H24N2O5S/c1-15-21(18-6-5-7-19(14-18)22(25)28-3)16(2)24(23-15)20-10-8-17(9-11-20)12-13-29-30(4,26)27/h5-11,14H,12-13H2,1-4H3