3-[[5-(azaniumylmethyl)-2-methoxy-phenyl]sulfonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[5-(azaniumylmethyl)-2-methoxy-phenyl]sulfonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[5-(azaniumylmethyl)-2-methoxy-phenyl]sulfonylamino]propyl-dimethyl-ammonium CAS Name: 3-[[5-(ammoniomethyl)-2-methoxyphenyl]sulfonylamino]propyl-dimethylammonium IUPAC Name: 3-[[5-(azaniumylmethyl)-2-methoxyphenyl]sulfonylamino]propyl-dimethylazanium Traditional Name: 3-[[5-(ammoniomethyl)-2-methoxy-phenyl]sulfonylamino]propyl-dimethyl-ammonium Formula: C13H25N3O3S+2 MolecularWeight: 303.4209

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23N3O3S/c1-16(2)8-4-7-15-20(17,18)13-9-11(10-14)5-6-12(13)19-3/h5-6,9,15H,4,7-8,10,14H2,1-3H3/p+2