3-[2-(3,5-dimethylphenoxy)ethyl-methyl-sulfamoyl]-4,5-dimethyl-benzoic acid

Systemtic Name: 3-[2-(3,5-dimethylphenoxy)ethyl-methyl-sulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[2-(3,5-dimethylphenoxy)ethyl-methyl-sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[2-(3,5-dimethylphenoxy)ethyl-methylsulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[2-(3,5-dimethylphenoxy)ethyl-methylsulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[2-(3,5-dimethylphenoxy)ethyl-methyl-sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCN(C)S(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCN(C)S(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)O)C

InChI

InChI=1S/C20H25NO5S/c1-13-8-14(2)10-18(9-13)26-7-6-21(5)27(24,25)19-12-17(20(22)23)11-15(3)16(19)4/h8-12H,6-7H2,1-5H3,(H,22,23)