3-[[3-(azaniumylmethyl)-4-methoxy-phenyl]sulfonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[3-(azaniumylmethyl)-4-methoxy-phenyl]sulfonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[3-(azaniumylmethyl)-4-methoxy-phenyl]sulfonylamino]propyl-dimethyl-ammonium CAS Name: 3-[[3-(ammoniomethyl)-4-methoxyphenyl]sulfonylamino]propyl-dimethylammonium IUPAC Name: 3-[[3-(azaniumylmethyl)-4-methoxyphenyl]sulfonylamino]propyl-dimethylazanium Traditional Name: 3-[[3-(ammoniomethyl)-4-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=CC(=C(C=C1)OC)C[NH3+]

Isomeric SMILES

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

InChI

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