trioctyl-[[1-[2-[(trioctylazaniumyl)methyl]naphthalen-1-yl]naphthalen-2-yl]methyl]azanium

Systemtic Name: trioctyl-[[1-[2-[(trioctylazaniumyl)methyl]naphthalen-1-yl]naphthalen-2-yl]methyl]azanium Openeye Name: trioctyl-[[1-[2-[(trioctylammonio)methyl]-1-naphthyl]-2-naphthyl]methyl]ammonium CAS Name: trioctyl-[[1-[2-[(trioctylammonio)methyl]-1-naphthalenyl]-2-naphthalenyl]methyl]ammonium IUPAC Name: trioctyl-[[1-[2-[(trioctylazaniumyl)methyl]naphthalen-1-yl]naphthalen-2-yl]methyl]azanium Traditional Name: trioctyl-[[1-[2-[(trioctylammonio)methyl]-1-naphthyl]-2-naphthyl]methyl]ammonium Formula: C70H118N2+2 MolecularWeight: 987.69932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)C[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC

Isomeric SMILES

CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)C[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC

InChI

InChI=1S/C70H118N2/c1-7-13-19-25-31-41-55-71(56-42-32-26-20-14-8-2,57-43-33-27-21-15-9-3)61-65-53-51-63-47-37-39-49-67(63)69(65)70-66(54-52-64-48-38-40-50-68(64)70)62-72(58-44-34-28-22-16-10-4,59-45-35-29-23-17-11-5)60-46-36-30-24-18-12-6/h37-40,47-54H,7-36,41-46,55-62H2,1-6H3/q+2