ethyl-hexyl-(4-oxidanylidene-4-propan-2-yloxy-2-propan-2-yloxycarbonyl-butanethioyl)-sulfanyl-azanium

Systemtic Name: ethyl-hexyl-(4-oxidanylidene-4-propan-2-yloxy-2-propan-2-yloxycarbonyl-butanethioyl)-sulfanyl-azanium Openeye Name: ethyl-hexyl-(4-isopropoxy-2-isopropoxycarbonyl-4-oxo-butanethioyl)-sulfanyl-ammonium CAS Name: ethyl-hexyl-mercapto-[4-oxo-2-[oxo(propan-2-yloxy)methyl]-4-propan-2-yloxy-1-sulfanylidenebutyl]ammonium IUPAC Name: ethyl-hexyl-(4-oxo-4-propan-2-yloxy-2-propan-2-yloxycarbonylbutanethioyl)-sulfanylazanium Traditional Name: ethyl-hexyl-(4-isopropoxy-2-isopropoxycarbonyl-4-keto-butanethioyl)-mercapto-ammonium Formula: C19H36NO4S2+ MolecularWeight: 406.62344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H36NO4S2/c1-7-9-10-11-12-20(26,8-2)18(25)16(19(22)24-15(5)6)13-17(21)23-14(3)4/h14-16,26H,7-13H2,1-6H3/q+1