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7-[3-[7-[diethyl(methyl)azaniumyl]heptoxycarbonyl]-2,4-diphenyl-cyclobutyl]carbonyloxyheptyl-diethyl-methyl-azanium

7-[3-[7-[diethyl(methyl)azaniumyl]heptoxycarbonyl]-2,4-diphenyl-cyclobutyl]carbonyloxyheptyl-diethyl-methyl-azanium

Systemtic Name:7-[3-[7-[diethyl(methyl)azaniumyl]heptoxycarbonyl]-2,4-diphenyl-cyclobutyl]carbonyloxyheptyl-diethyl-methyl-azanium
Openeye Name:7-[3-[7-[diethyl(methyl)ammonio]heptoxycarbonyl]-2,4-diphenyl-cyclobutanecarbonyl]oxyheptyl-diethyl-methyl-ammonium
CAS Name:7-[[3-[7-[diethyl(methyl)ammonio]heptoxy-oxomethyl]-2,4-diphenylcyclobutyl]-oxomethoxy]heptyl-diethyl-methylammonium
IUPAC Name:7-[3-[7-[diethyl(methyl)azaniumyl]heptoxycarbonyl]-2,4-diphenylcyclobutanecarbonyl]oxyheptyl-diethyl-methylazanium
Traditional Name:7-[3-[7-[diethyl(methyl)ammonio]heptoxycarbonyl]-2,4-diphenyl-cyclobutanecarbonyl]oxyheptyl-diethyl-methyl-ammonium
Formula: C42H68N2O4+2
MolecularWeight: 665.00032
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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCCCCCCOC(=O)C1C(C(C1C2=CC=CC=C2)C(=O)OCCCCCCC[N+](C)(CC)CC)C3=CC=CC=C3


Isomeric SMILES

CC[N+](C)(CC)CCCCCCCOC(=O)C1C(C(C1C2=CC=CC=C2)C(=O)OCCCCCCC[N+](C)(CC)CC)C3=CC=CC=C3


InChI

InChI=1S/C42H68N2O4/c1-7-43(5,8-2)31-23-13-11-15-25-33-47-41(45)39-37(35-27-19-17-20-28-35)40(38(39)36-29-21-18-22-30-36)42(46)48-34-26-16-12-14-24-32-44(6,9-3)10-4/h17-22,27-30,37-40H,7-16,23-26,31-34H2,1-6H3/q+2


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