[4-methoxycarbonyl-5-[4-[(5-methoxycarbonyl-2-triphenylphosphaniumyl-1,3-dithiol-4-yl)sulfanyl]butylsulfanyl]-1,3-dithiol-2-yl]-triphenyl-phosphanium

Systemtic Name: [4-methoxycarbonyl-5-[4-[(5-methoxycarbonyl-2-triphenylphosphaniumyl-1,3-dithiol-4-yl)sulfanyl]butylsulfanyl]-1,3-dithiol-2-yl]-triphenyl-phosphanium Openeye Name: [4-methoxycarbonyl-5-[4-[(5-methoxycarbonyl-2-triphenylphosphaniumyl-1,3-dithiol-4-yl)sulfanyl]butylsulfanyl]-1,3-dithiol-2-yl]-triphenyl-phosphonium CAS Name: [4-methoxycarbonyl-5-[4-[(5-methoxycarbonyl-2-triphenylphosphiniumyl-1,3-dithiol-4-yl)thio]butylthio]-1,3-dithiol-2-yl]-triphenylphosphonium IUPAC Name: [4-methoxycarbonyl-5-[4-[(5-methoxycarbonyl-2-triphenylphosphaniumyl-1,3-dithiol-4-yl)sulfanyl]butylsulfanyl]-1,3-dithiol-2-yl]-triphenylphosphanium Traditional Name: [4-carbomethoxy-5-[4-[(5-carbomethoxy-2-triphenylphosphiniumyl-1,3-dithiol-4-yl)thio]butylthio]-1,3-dithiol-2-yl]-triphenyl-phosphonium Formula: C50H46O4P2S6+2 MolecularWeight: 965.235362

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(S1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)SCCCCSC5=C(SC(S5)[P+](C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC(S1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)SCCCCSC5=C(SC(S5)[P+](C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)C(=O)OC

InChI

InChI=1S/C50H46O4P2S6/c1-53-45(51)43-47(61-49(59-43)55(37-23-9-3-10-24-37,38-25-11-4-12-26-38)39-27-13-5-14-28-39)57-35-21-22-36-58-48-44(46(52)54-2)60-50(62-48)56(40-29-15-6-16-30-40,41-31-17-7-18-32-41)42-33-19-8-20-34-42/h3-20,23-34,49-50H,21-22,35-36H2,1-2H3/q+2