3-[3-[ethyl(phenyl)amino]propylsulfamoyl]-4,5-dimethyl-benzoic acid

Systemtic Name: 3-[3-[ethyl(phenyl)amino]propylsulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[3-(N-ethylanilino)propylsulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[3-(N-ethylanilino)propylsulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[3-(N-ethylanilino)propylsulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[3-(N-ethylanilino)propylsulfamoyl]-4,5-dimethyl-benzoic acid Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNS(=O)(=O)C1=CC(=CC(=C1C)C)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCN(CCCNS(=O)(=O)C1=CC(=CC(=C1C)C)C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C20H26N2O4S/c1-4-22(18-9-6-5-7-10-18)12-8-11-21-27(25,26)19-14-17(20(23)24)13-15(2)16(19)3/h5-7,9-10,13-14,21H,4,8,11-12H2,1-3H3,(H,23,24)