[3-[(dimethylazaniumyl)methyl]-5-[methyl(sulfanylperoxy)amino]-2-oxidanyl-phenyl]methyl-dimethyl-azanium

Systemtic Name: [3-[(dimethylazaniumyl)methyl]-5-[methyl(sulfanylperoxy)amino]-2-oxidanyl-phenyl]methyl-dimethyl-azanium Openeye Name: [3-[(dimethylammonio)methyl]-2-hydroxy-5-[methyl(sulfanylperoxy)amino]phenyl]methyl-dimethyl-ammonium CAS Name: [3-[(dimethylammonio)methyl]-2-hydroxy-5-[mercaptodioxy(methyl)amino]phenyl]methyl-dimethylammonium IUPAC Name: [3-[(dimethylazaniumyl)methyl]-2-hydroxy-5-[methyl(sulfanylperoxy)amino]phenyl]methyl-dimethylazanium Traditional Name: [3-[(dimethylammonio)methyl]-2-hydroxy-5-[mercaptoperoxy(methyl)amino]benzyl]-dimethyl-ammonium Formula: C13H25N3O3S+2 MolecularWeight: 303.4209

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC(=CC(=C1O)C[NH+](C)C)N(C)OOS

Isomeric SMILES

C[NH+](C)CC1=CC(=CC(=C1O)C[NH+](C)C)N(C)OOS

InChI

InChI=1S/C13H23N3O3S/c1-14(2)8-10-6-12(16(5)18-19-20)7-11(13(10)17)9-15(3)4/h6-7,17,20H,8-9H2,1-5H3/p+2