(4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanethioyl)-methyl-octyl-sulfanyl-azanium

Systemtic Name: (4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanethioyl)-methyl-octyl-sulfanyl-azanium Openeye Name: (4-methoxy-2-methoxycarbonyl-4-oxo-butanethioyl)-methyl-octyl-sulfanyl-ammonium CAS Name: mercapto-(4-methoxy-2-methoxycarbonyl-4-oxo-1-sulfanylidenebutyl)-methyl-octylammonium IUPAC Name: (4-methoxy-2-methoxycarbonyl-4-oxobutanethioyl)-methyl-octyl-sulfanylazanium Traditional Name: (2-carbomethoxy-4-keto-4-methoxy-butanethioyl)-mercapto-methyl-octyl-ammonium Formula: C16H30NO4S2+ MolecularWeight: 364.5437

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](C)(C(=S)C(CC(=O)OC)C(=O)OC)S

Isomeric SMILES

CCCCCCCC[N+](C)(C(=S)C(CC(=O)OC)C(=O)OC)S

InChI

InChI=1S/C16H30NO4S2/c1-5-6-7-8-9-10-11-17(2,23)15(22)13(16(19)21-4)12-14(18)20-3/h13,23H,5-12H2,1-4H3/q+1