3-[[2-(azaniumylmethyl)phenyl]methylsulfonylamino]propyl-diethyl-azanium

Systemtic Name: 3-[[2-(azaniumylmethyl)phenyl]methylsulfonylamino]propyl-diethyl-azanium Openeye Name: 3-[[2-(azaniumylmethyl)phenyl]methylsulfonylamino]propyl-diethyl-ammonium CAS Name: 3-[[2-(ammoniomethyl)phenyl]methylsulfonylamino]propyl-diethylammonium IUPAC Name: 3-[[2-(azaniumylmethyl)phenyl]methylsulfonylamino]propyl-diethylazanium Traditional Name: 3-[[2-(ammoniomethyl)benzyl]sulfonylamino]propyl-diethyl-ammonium Formula: C15H29N3O2S+2 MolecularWeight: 315.47466

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNS(=O)(=O)CC1=CC=CC=C1C[NH3+]

Isomeric SMILES

CC[NH+](CC)CCCNS(=O)(=O)CC1=CC=CC=C1C[NH3+]

InChI

InChI=1S/C15H27N3O2S/c1-3-18(4-2)11-7-10-17-21(19,20)13-15-9-6-5-8-14(15)12-16/h5-6,8-9,17H,3-4,7,10-13,16H2,1-2H3/p+2