methyl 5-[4-[(5-methoxycarbonyl-1,3-dithiol-3-ium-4-yl)sulfanyl]butylsulfanyl]-1,3-dithiol-1-ium-4-carboxylate

Systemtic Name: methyl 5-[4-[(5-methoxycarbonyl-1,3-dithiol-3-ium-4-yl)sulfanyl]butylsulfanyl]-1,3-dithiol-1-ium-4-carboxylate Openeye Name: methyl 5-[4-[(5-methoxycarbonyl-1,3-dithiol-3-ium-4-yl)sulfanyl]butylsulfanyl]-1,3-dithiol-1-ium-4-carboxylate CAS Name: 5-[4-[(5-methoxycarbonyl-1,3-dithiol-3-ium-4-yl)thio]butylthio]-1,3-dithiol-1-ium-4-carboxylic acid methyl ester IUPAC Name: methyl 5-[4-[(5-methoxycarbonyl-1,3-dithiol-3-ium-4-yl)sulfanyl]butylsulfanyl]-1,3-dithiol-1-ium-4-carboxylate Traditional Name: 5-[4-[(5-carbomethoxy-1,3-dithiol-3-ium-4-yl)thio]butylthio]-1,3-dithiol-1-ium-4-carboxylic acid methyl ester Formula: C14H16O4S6+2 MolecularWeight: 440.66444

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C([S+]=CS1)SCCCCSC2=C(SC=[S+]2)C(=O)OC

Isomeric SMILES

COC(=O)C1=C([S+]=CS1)SCCCCSC2=C(SC=[S+]2)C(=O)OC

InChI

InChI=1S/C14H16O4S6/c1-17-11(15)9-13(23-7-21-9)19-5-3-4-6-20-14-10(12(16)18-2)22-8-24-14/h7-8H,3-6H2,1-2H3/q+2