3-(dimethylsulfamoyl)-4-phenoxy-5-[(phenylmethyl)amino]benzoic acid

Systemtic Name: 3-(dimethylsulfamoyl)-4-phenoxy-5-[(phenylmethyl)amino]benzoic acid Openeye Name: 3-(benzylamino)-5-(dimethylsulfamoyl)-4-phenoxy-benzoic acid CAS Name: 3-(dimethylsulfamoyl)-4-phenoxy-5-[(phenylmethyl)amino]benzoic acid IUPAC Name: 3-(benzylamino)-5-(dimethylsulfamoyl)-4-phenoxybenzoic acid Traditional Name: 3-(benzylamino)-5-(dimethylsulfamoyl)-4-phenoxy-benzoic acid Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=CC(=C1OC2=CC=CC=C2)NCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=CC(=C1OC2=CC=CC=C2)NCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H22N2O5S/c1-24(2)30(27,28)20-14-17(22(25)26)13-19(23-15-16-9-5-3-6-10-16)21(20)29-18-11-7-4-8-12-18/h3-14,23H,15H2,1-2H3,(H,25,26)