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

Systemtic Name: 4-[2-(3,5-dimethylphenoxy)ethyl-methyl-sulfamoyl]benzoic acid Openeye Name: 4-[2-(3,5-dimethylphenoxy)ethyl-methyl-sulfamoyl]benzoic acid CAS Name: 4-[2-(3,5-dimethylphenoxy)ethyl-methylsulfamoyl]benzoic acid IUPAC Name: 4-[2-(3,5-dimethylphenoxy)ethyl-methylsulfamoyl]benzoic acid Traditional Name: 4-[2-(3,5-dimethylphenoxy)ethyl-methyl-sulfamoyl]benzoic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO5S/c1-13-10-14(2)12-16(11-13)24-9-8-19(3)25(22,23)17-6-4-15(5-7-17)18(20)21/h4-7,10-12H,8-9H2,1-3H3,(H,20,21)