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2-[5-[(6-ethoxy-6-oxidanylidene-hexyl)carbamoyl]-2-phenylmethoxy-3-[2-(triethylazaniumyl)ethoxy]phenoxy]ethyl-triethyl-azanium

2-[5-[(6-ethoxy-6-oxidanylidene-hexyl)carbamoyl]-2-phenylmethoxy-3-[2-(triethylazaniumyl)ethoxy]phenoxy]ethyl-triethyl-azanium

Systemtic Name:2-[5-[(6-ethoxy-6-oxidanylidene-hexyl)carbamoyl]-2-phenylmethoxy-3-[2-(triethylazaniumyl)ethoxy]phenoxy]ethyl-triethyl-azanium
Openeye Name:2-[2-benzyloxy-5-[(6-ethoxy-6-oxo-hexyl)carbamoyl]-3-[2-(triethylammonio)ethoxy]phenoxy]ethyl-triethyl-ammonium
CAS Name:2-[5-[[(6-ethoxy-6-oxohexyl)amino]-oxomethyl]-2-phenylmethoxy-3-[2-(triethylammonio)ethoxy]phenoxy]ethyl-triethylammonium
IUPAC Name:2-[5-[(6-ethoxy-6-oxohexyl)carbamoyl]-2-phenylmethoxy-3-[2-(triethylazaniumyl)ethoxy]phenoxy]ethyl-triethylazanium
Traditional Name:2-[2-benzoxy-5-[(6-ethoxy-6-keto-hexyl)carbamoyl]-3-[2-(triethylammonio)ethoxy]phenoxy]ethyl-triethyl-ammonium
Formula: C38H63N3O6+2
MolecularWeight: 657.92332
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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCOC1=CC(=CC(=C1OCC2=CC=CC=C2)OCC[N+](CC)(CC)CC)C(=O)NCCCCCC(=O)OCC


Isomeric SMILES

CC[N+](CC)(CC)CCOC1=CC(=CC(=C1OCC2=CC=CC=C2)OCC[N+](CC)(CC)CC)C(=O)NCCCCCC(=O)OCC


InChI

InChI=1S/C38H62N3O6/c1-8-40(9-2,10-3)25-27-45-34-29-33(38(43)39-24-20-16-19-23-36(42)44-14-7)30-35(46-28-26-41(11-4,12-5)13-6)37(34)47-31-32-21-17-15-18-22-32/h15,17-18,21-22,29-30H,8-14,16,19-20,23-28,31H2,1-7H3/q+1/p+1


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