dimethyl-(4-phenoxybutyl)-sulfanylcarbonyl-azanium

Systemtic Name: dimethyl-(4-phenoxybutyl)-sulfanylcarbonyl-azanium Openeye Name: dimethyl-(4-phenoxybutyl)-sulfanylcarbonyl-ammonium CAS Name: [mercapto(oxo)methyl]-dimethyl-(4-phenoxybutyl)ammonium IUPAC Name: dimethyl-(4-phenoxybutyl)-sulfanylcarbonylazanium Traditional Name: dimethyl-(4-phenoxybutyl)-thiocarboxy-ammonium Formula: C13H20NO2S+ MolecularWeight: 254.3684

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCCOC1=CC=CC=C1)C(=O)S

Isomeric SMILES

C[N+](C)(CCCCOC1=CC=CC=C1)C(=O)S

InChI

InChI=1S/C13H19NO2S/c1-14(2,13(15)17)10-6-7-11-16-12-8-4-3-5-9-12/h3-5,8-9H,6-7,10-11H2,1-2H3/p+1