ethyl-hexyl-(4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanethioyl)-sulfanyl-azanium

Systemtic Name: ethyl-hexyl-(4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanethioyl)-sulfanyl-azanium Openeye Name: ethyl-hexyl-(4-methoxy-2-methoxycarbonyl-4-oxo-butanethioyl)-sulfanyl-ammonium CAS Name: ethyl-hexyl-mercapto-(4-methoxy-2-methoxycarbonyl-4-oxo-1-sulfanylidenebutyl)ammonium IUPAC Name: ethyl-hexyl-(4-methoxy-2-methoxycarbonyl-4-oxobutanethioyl)-sulfanylazanium Traditional Name: (2-carbomethoxy-4-keto-4-methoxy-butanethioyl)-ethyl-hexyl-mercapto-ammonium Formula: C15H28NO4S2+ MolecularWeight: 350.51712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H28NO4S2/c1-5-7-8-9-10-16(22,6-2)14(21)12(15(18)20-4)11-13(17)19-3/h12,22H,5-11H2,1-4H3/q+1