[2-[[[5-(diethylsulfamoyl)pyridin-1-ium-2-yl]amino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[[5-(diethylsulfamoyl)pyridin-1-ium-2-yl]amino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[5-(diethylsulfamoyl)pyridin-1-ium-2-yl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[5-(diethylsulfamoyl)-2-pyridin-1-iumyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[5-(diethylsulfamoyl)pyridin-1-ium-2-yl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[5-(diethylsulfamoyl)pyridin-1-ium-2-yl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C19H30N4O2S+2 MolecularWeight: 378.5321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C[NH+]=C(C=C1)NCC2=CC=CC=C2C[NH+](C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C[NH+]=C(C=C1)NCC2=CC=CC=C2C[NH+](C)C

InChI

InChI=1S/C19H28N4O2S/c1-5-23(6-2)26(24,25)18-11-12-19(21-14-18)20-13-16-9-7-8-10-17(16)15-22(3)4/h7-12,14H,5-6,13,15H2,1-4H3,(H,20,21)/p+2