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

Systemtic Name: (4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanethioyl)-dipentyl-sulfanyl-azanium Openeye Name: (4-methoxy-2-methoxycarbonyl-4-oxo-butanethioyl)-dipentyl-sulfanyl-ammonium CAS Name: mercapto-(4-methoxy-2-methoxycarbonyl-4-oxo-1-sulfanylidenebutyl)-dipentylammonium IUPAC Name: (4-methoxy-2-methoxycarbonyl-4-oxobutanethioyl)-dipentyl-sulfanylazanium Traditional Name: diamyl-(2-carbomethoxy-4-keto-4-methoxy-butanethioyl)-mercapto-ammonium Formula: C17H32NO4S2+ MolecularWeight: 378.57028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H32NO4S2/c1-5-7-9-11-18(24,12-10-8-6-2)16(23)14(17(20)22-4)13-15(19)21-3/h14,24H,5-13H2,1-4H3/q+1