3-[[4-(dimethylsulfamoyl)phenyl]carbonylamino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[[4-(dimethylsulfamoyl)phenyl]carbonylamino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[4-(dimethylsulfamoyl)benzoyl]amino]propyl]-methyl-ammonium CAS Name: 3-[[[4-(dimethylsulfamoyl)phenyl]-oxomethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[4-(dimethylsulfamoyl)benzoyl]amino]propyl]-methylazanium Traditional Name: benzyl-[3-[[4-(dimethylsulfamoyl)benzoyl]amino]propyl]-methyl-ammonium Formula: C20H28N3O3S+ MolecularWeight: 390.51962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)C)CC2=CC=CC=C2

Isomeric SMILES

C[NH+](CCCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C20H27N3O3S/c1-22(2)27(25,26)19-12-10-18(11-13-19)20(24)21-14-7-15-23(3)16-17-8-5-4-6-9-17/h4-6,8-13H,7,14-16H2,1-3H3,(H,21,24)/p+1