[4-azaniumyl-3-[2-(methylsulfonylamino)ethyl]phenyl]-diethyl-azanium

Systemtic Name: [4-azaniumyl-3-[2-(methylsulfonylamino)ethyl]phenyl]-diethyl-azanium Openeye Name: [4-azaniumyl-3-[2-(methanesulfonamido)ethyl]phenyl]-diethyl-ammonium CAS Name: [4-ammonio-3-[2-(methanesulfonamido)ethyl]phenyl]-diethylammonium IUPAC Name: [4-azaniumyl-3-[2-(methanesulfonamido)ethyl]phenyl]-diethylazanium Traditional Name: [4-ammonio-3-[2-(methanesulfonamido)ethyl]phenyl]-diethyl-ammonium Formula: C13H25N3O2S+2 MolecularWeight: 287.4215

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1=CC(=C(C=C1)[NH3+])CCNS(=O)(=O)C

Isomeric SMILES

CC[NH+](CC)C1=CC(=C(C=C1)[NH3+])CCNS(=O)(=O)C

InChI

InChI=1S/C13H23N3O2S/c1-4-16(5-2)12-6-7-13(14)11(10-12)8-9-15-19(3,17)18/h6-7,10,15H,4-5,8-9,14H2,1-3H3/p+2