3-[(2-methoxy-5-methyl-phenyl)methyl-methyl-sulfamoyl]-4-methyl-benzoic acid

Systemtic Name: 3-[(2-methoxy-5-methyl-phenyl)methyl-methyl-sulfamoyl]-4-methyl-benzoic acid Openeye Name: 3-[(2-methoxy-5-methyl-phenyl)methyl-methyl-sulfamoyl]-4-methyl-benzoic acid CAS Name: 3-[(2-methoxy-5-methylphenyl)methyl-methylsulfamoyl]-4-methylbenzoic acid IUPAC Name: 3-[(2-methoxy-5-methylphenyl)methyl-methylsulfamoyl]-4-methylbenzoic acid Traditional Name: 3-[(2-methoxy-5-methyl-benzyl)-methyl-sulfamoyl]-4-methyl-benzoic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN(C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN(C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C18H21NO5S/c1-12-5-8-16(24-4)15(9-12)11-19(3)25(22,23)17-10-14(18(20)21)7-6-13(17)2/h5-10H,11H2,1-4H3,(H,20,21)