(4-butoxy-2-butoxycarbonyl-4-oxidanylidene-butanethioyl)-ethyl-methyl-sulfanyl-azanium

Systemtic Name: (4-butoxy-2-butoxycarbonyl-4-oxidanylidene-butanethioyl)-ethyl-methyl-sulfanyl-azanium Openeye Name: (4-butoxy-2-butoxycarbonyl-4-oxo-butanethioyl)-ethyl-methyl-sulfanyl-ammonium CAS Name: [4-butoxy-2-[butoxy(oxo)methyl]-4-oxo-1-sulfanylidenebutyl]-ethyl-mercapto-methylammonium IUPAC Name: (4-butoxy-2-butoxycarbonyl-4-oxobutanethioyl)-ethyl-methyl-sulfanylazanium Traditional Name: (4-butoxy-2-butoxycarbonyl-4-keto-butanethioyl)-ethyl-mercapto-methyl-ammonium Formula: C16H30NO4S2+ MolecularWeight: 364.5437

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC(C(=S)[N+](C)(CC)S)C(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)CC(C(=S)[N+](C)(CC)S)C(=O)OCCCC

InChI

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