1-tetradecyl-4-[10-(1-tetradecylpyridin-1-ium-4-yl)sulfanyldecylsulfanyl]pyridin-1-ium

Systemtic Name: 1-tetradecyl-4-[10-(1-tetradecylpyridin-1-ium-4-yl)sulfanyldecylsulfanyl]pyridin-1-ium Openeye Name: 1-tetradecyl-4-[10-(1-tetradecylpyridin-1-ium-4-yl)sulfanyldecylsulfanyl]pyridin-1-ium CAS Name: 1-tetradecyl-4-[10-[(1-tetradecyl-4-pyridin-1-iumyl)thio]decylthio]pyridin-1-ium IUPAC Name: 1-tetradecyl-4-[10-(1-tetradecylpyridin-1-ium-4-yl)sulfanyldecylsulfanyl]pyridin-1-ium Traditional Name: 1-myristyl-4-[10-[(1-myristylpyridin-1-ium-4-yl)thio]decylthio]pyridin-1-ium Formula: C48H86N2S2+2 MolecularWeight: 755.33984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+]1=CC=C(C=C1)SCCCCCCCCCCSC2=CC=[N+](C=C2)CCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCC[N+]1=CC=C(C=C1)SCCCCCCCCCCSC2=CC=[N+](C=C2)CCCCCCCCCCCCCC

InChI

InChI=1S/C48H86N2S2/c1-3-5-7-9-11-13-15-17-19-23-27-31-39-49-41-35-47(36-42-49)51-45-33-29-25-21-22-26-30-34-46-52-48-37-43-50(44-38-48)40-32-28-24-20-18-16-14-12-10-8-6-4-2/h35-38,41-44H,3-34,39-40,45-46H2,1-2H3/q+2