2-[[1-[4-[4-[6-[2-[diethyl(methyl)azaniumyl]ethoxy]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]phenyl]phenyl]-6-bicyclo[4.2.0]octa-2,4,7-trienyl]oxy]ethyl-diethyl-methyl-azanium

Systemtic Name: 2-[[1-[4-[4-[6-[2-[diethyl(methyl)azaniumyl]ethoxy]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]phenyl]phenyl]-6-bicyclo[4.2.0]octa-2,4,7-trienyl]oxy]ethyl-diethyl-methyl-azanium Openeye Name: 2-[[1-[4-[4-[6-[2-[diethyl(methyl)ammonio]ethoxy]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]phenyl]phenyl]-6-bicyclo[4.2.0]octa-2,4,7-trienyl]oxy]ethyl-diethyl-methyl-ammonium CAS Name: 2-[[1-[4-[4-[6-[2-[diethyl(methyl)ammonio]ethoxy]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]phenyl]phenyl]-6-bicyclo[4.2.0]octa-2,4,7-trienyl]oxy]ethyl-diethyl-methylammonium IUPAC Name: 2-[[1-[4-[4-[6-[2-[diethyl(methyl)azaniumyl]ethoxy]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]phenyl]phenyl]-6-bicyclo[4.2.0]octa-2,4,7-trienyl]oxy]ethyl-diethyl-methylazanium Traditional Name: 2-[[1-[4-[4-[6-[2-[diethyl(methyl)ammonio]ethoxy]-1-bicyclo[4.2.0]octa-2,4,7-trienyl]phenyl]phenyl]-6-bicyclo[4.2.0]octa-2,4,7-trienyl]oxy]ethyl-diethyl-methyl-ammonium Formula: C42H54N2O2+2 MolecularWeight: 618.89036

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCOC12C=CC=CC1(C=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)C56C=CC=CC5(C=C6)OCC[N+](C)(CC)CC

Isomeric SMILES

CC[N+](C)(CC)CCOC12C=CC=CC1(C=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)C56C=CC=CC5(C=C6)OCC[N+](C)(CC)CC

InChI

InChI=1S/C42H54N2O2/c1-7-43(5,8-2)31-33-45-41-25-13-11-23-39(41,27-29-41)37-19-15-35(16-20-37)36-17-21-38(22-18-36)40-24-12-14-26-42(40,30-28-40)46-34-32-44(6,9-3)10-4/h11-30H,7-10,31-34H2,1-6H3/q+2