N,N-dimethyl-3-[[5-oxidanidyl-4-(phenylsulfonyl)-1,2,5-oxadiazol-5-ium-3-yl]oxy]propan-1-amine

Systemtic Name: N,N-dimethyl-3-[[5-oxidanidyl-4-(phenylsulfonyl)-1,2,5-oxadiazol-5-ium-3-yl]oxy]propan-1-amine Openeye Name: 3-[[4-(benzenesulfonyl)-5-oxido-1,2,5-oxadiazol-5-ium-3-yl]oxy]-N,N-dimethyl-propan-1-amine CAS Name: 3-[[4-(benzenesulfonyl)-5-oxido-1,2,5-oxadiazol-5-ium-3-yl]oxy]-N,N-dimethyl-1-propanamine IUPAC Name: 3-[[4-(benzenesulfonyl)-5-oxido-1,2,5-oxadiazol-5-ium-3-yl]oxy]-N,N-dimethylpropan-1-amine Traditional Name: 3-(4-besyl-5-oxido-furazan-5-ium-3-yl)oxypropyl-dimethyl-amine Formula: C13H17N3O5S MolecularWeight: 327.35618

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=NO[N+](=C1S(=O)(=O)C2=CC=CC=C2)[O-]

Isomeric SMILES

CN(C)CCCOC1=NO[N+](=C1S(=O)(=O)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C13H17N3O5S/c1-15(2)9-6-10-20-12-13(16(17)21-14-12)22(18,19)11-7-4-3-5-8-11/h3-5,7-8H,6,9-10H2,1-2H3