[3-[3-[3-[diethyl-(phenylmethyl)azaniumyl]-2-oxidanyl-propoxy]phenoxy]-2-oxidanyl-propyl]-diethyl-(phenylmethyl)azanium

Systemtic Name: [3-[3-[3-[diethyl-(phenylmethyl)azaniumyl]-2-oxidanyl-propoxy]phenoxy]-2-oxidanyl-propyl]-diethyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[3-[3-[benzyl(diethyl)ammonio]-2-hydroxy-propoxy]phenoxy]-2-hydroxy-propyl]-diethyl-ammonium CAS Name: [3-[3-[3-[diethyl-(phenylmethyl)ammonio]-2-hydroxypropoxy]phenoxy]-2-hydroxypropyl]-diethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[3-[3-[benzyl(diethyl)azaniumyl]-2-hydroxypropoxy]phenoxy]-2-hydroxypropyl]-diethylazanium Traditional Name: benzyl-[3-[3-[3-[benzyl(diethyl)ammonio]-2-hydroxy-propoxy]phenoxy]-2-hydroxy-propyl]-diethyl-ammonium Formula: C34H50N2O4+2 MolecularWeight: 550.7718

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC1=CC=CC=C1)CC(COC2=CC(=CC=C2)OCC(C[N+](CC)(CC)CC3=CC=CC=C3)O)O

Isomeric SMILES

CC[N+](CC)(CC1=CC=CC=C1)CC(COC2=CC(=CC=C2)OCC(C[N+](CC)(CC)CC3=CC=CC=C3)O)O

InChI

InChI=1S/C34H50N2O4/c1-5-35(6-2,23-29-16-11-9-12-17-29)25-31(37)27-39-33-20-15-21-34(22-33)40-28-32(38)26-36(7-3,8-4)24-30-18-13-10-14-19-30/h9-22,31-32,37-38H,5-8,23-28H2,1-4H3/q+2