diethyl 2-[6-[[5-(8-ethoxy-7-ethoxycarbonyl-8-oxidanylidene-octyl)sulfanyl-2-sulfanylidene-1,3-dithiol-4-yl]sulfanyl]hexyl]propanedioate

Systemtic Name: diethyl 2-[6-[[5-(8-ethoxy-7-ethoxycarbonyl-8-oxidanylidene-octyl)sulfanyl-2-sulfanylidene-1,3-dithiol-4-yl]sulfanyl]hexyl]propanedioate Openeye Name: diethyl 2-[6-[[5-(8-ethoxy-7-ethoxycarbonyl-8-oxo-octyl)sulfanyl-2-thioxo-1,3-dithiol-4-yl]sulfanyl]hexyl]propanedioate CAS Name: 2-[6-[[5-[(8-ethoxy-7-ethoxycarbonyl-8-oxooctyl)thio]-2-sulfanylidene-1,3-dithiol-4-yl]thio]hexyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[6-[[5-(8-ethoxy-7-ethoxycarbonyl-8-oxooctyl)sulfanyl-2-sulfanylidene-1,3-dithiol-4-yl]sulfanyl]hexyl]propanedioate Traditional Name: 2-[6-[[5-[(7-carbethoxy-8-ethoxy-8-keto-octyl)thio]-2-thioxo-1,3-dithiol-4-yl]thio]hexyl]malonic acid diethyl ester Formula: C29H46O8S5 MolecularWeight: 682.99574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCCSC1=C(SC(=S)S1)SCCCCCCC(C(=O)OCC)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCCCCCSC1=C(SC(=S)S1)SCCCCCCC(C(=O)OCC)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C29H46O8S5/c1-5-34-23(30)21(24(31)35-6-2)17-13-9-11-15-19-39-27-28(42-29(38)41-27)40-20-16-12-10-14-18-22(25(32)36-7-3)26(33)37-8-4/h21-22H,5-20H2,1-4H3