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

Systemtic Name: [4-methoxycarbonyl-5-[3-[(5-methoxycarbonyl-2-triphenylphosphaniumyl-1,3-dithiol-4-yl)sulfanyl]propylsulfanyl]-1,3-dithiol-2-yl]-triphenyl-phosphanium Openeye Name: [4-methoxycarbonyl-5-[3-[(5-methoxycarbonyl-2-triphenylphosphaniumyl-1,3-dithiol-4-yl)sulfanyl]propylsulfanyl]-1,3-dithiol-2-yl]-triphenyl-phosphonium CAS Name: [4-methoxycarbonyl-5-[3-[(5-methoxycarbonyl-2-triphenylphosphiniumyl-1,3-dithiol-4-yl)thio]propylthio]-1,3-dithiol-2-yl]-triphenylphosphonium IUPAC Name: [4-methoxycarbonyl-5-[3-[(5-methoxycarbonyl-2-triphenylphosphaniumyl-1,3-dithiol-4-yl)sulfanyl]propylsulfanyl]-1,3-dithiol-2-yl]-triphenylphosphanium Traditional Name: [4-carbomethoxy-5-[3-[(5-carbomethoxy-2-triphenylphosphiniumyl-1,3-dithiol-4-yl)thio]propylthio]-1,3-dithiol-2-yl]-triphenyl-phosphonium Formula: C49H44O4P2S6+2 MolecularWeight: 951.208782

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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)SCCCSC5=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)SCCCSC5=C(SC(S5)[P+](C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)C(=O)OC

InChI

InChI=1S/C49H44O4P2S6/c1-52-44(50)42-46(60-48(58-42)54(36-22-9-3-10-23-36,37-24-11-4-12-25-37)38-26-13-5-14-27-38)56-34-21-35-57-47-43(45(51)53-2)59-49(61-47)55(39-28-15-6-16-29-39,40-30-17-7-18-31-40)41-32-19-8-20-33-41/h3-20,22-33,48-49H,21,34-35H2,1-2H3/q+2