(4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanethioyl)-dimethyl-sulfanyl-azanium

Systemtic Name: (4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanethioyl)-dimethyl-sulfanyl-azanium Openeye Name: (4-methoxy-2-methoxycarbonyl-4-oxo-butanethioyl)-dimethyl-sulfanyl-ammonium CAS Name: mercapto-(4-methoxy-2-methoxycarbonyl-4-oxo-1-sulfanylidenebutyl)-dimethylammonium IUPAC Name: (4-methoxy-2-methoxycarbonyl-4-oxobutanethioyl)-dimethyl-sulfanylazanium Traditional Name: (2-carbomethoxy-4-keto-4-methoxy-butanethioyl)-mercapto-dimethyl-ammonium Formula: C9H16NO4S2+ MolecularWeight: 266.35764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16NO4S2/c1-10(2,16)8(15)6(9(12)14-4)5-7(11)13-3/h6,16H,5H2,1-4H3/q+1