3-[1-(dimethylsulfamoyl)-5-(methoxymethyl)pyrazol-4-yl]-2-methyl-6-phenyl-benzoic acid

Systemtic Name: 3-[1-(dimethylsulfamoyl)-5-(methoxymethyl)pyrazol-4-yl]-2-methyl-6-phenyl-benzoic acid Openeye Name: 3-[1-(dimethylsulfamoyl)-5-(methoxymethyl)pyrazol-4-yl]-2-methyl-6-phenyl-benzoic acid CAS Name: 3-[1-(dimethylsulfamoyl)-5-(methoxymethyl)-4-pyrazolyl]-2-methyl-6-phenylbenzoic acid IUPAC Name: 3-[1-(dimethylsulfamoyl)-5-(methoxymethyl)pyrazol-4-yl]-2-methyl-6-phenylbenzoic acid Traditional Name: 3-[1-(dimethylsulfamoyl)-5-(methoxymethyl)pyrazol-4-yl]-2-methyl-6-phenyl-benzoic acid Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C(=O)O)C2=CC=CC=C2)C3=C(N(N=C3)S(=O)(=O)N(C)C)COC

Isomeric SMILES

CC1=C(C=CC(=C1C(=O)O)C2=CC=CC=C2)C3=C(N(N=C3)S(=O)(=O)N(C)C)COC

InChI

InChI=1S/C21H23N3O5S/c1-14-16(10-11-17(20(14)21(25)26)15-8-6-5-7-9-15)18-12-22-24(19(18)13-29-4)30(27,28)23(2)3/h5-12H,13H2,1-4H3,(H,25,26)