2-[3,4-bis(phenylmethoxy)phenyl]ethyl-methyl-[6-oxidanylidene-6-(phenethylamino)hexyl]-phenyl-azanium

Systemtic Name: 2-[3,4-bis(phenylmethoxy)phenyl]ethyl-methyl-[6-oxidanylidene-6-(phenethylamino)hexyl]-phenyl-azanium Openeye Name: 2-(3,4-dibenzyloxyphenyl)ethyl-methyl-[6-oxo-6-(phenethylamino)hexyl]-phenyl-ammonium CAS Name: 2-[3,4-bis(phenylmethoxy)phenyl]ethyl-methyl-[6-oxo-6-(phenethylamino)hexyl]-phenylammonium IUPAC Name: 2-[3,4-bis(phenylmethoxy)phenyl]ethyl-methyl-[6-oxo-6-(phenethylamino)hexyl]-phenylazanium Traditional Name: 2-(3,4-dibenzoxyphenyl)ethyl-[6-keto-6-(phenethylamino)hexyl]-methyl-phenyl-ammonium Formula: C43H49N2O3+ MolecularWeight: 641.86076

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CCCCCC(=O)NCCC1=CC=CC=C1)(CCC2=CC(=C(C=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C[N+](CCCCCC(=O)NCCC1=CC=CC=C1)(CCC2=CC(=C(C=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C43H48N2O3/c1-45(40-23-13-5-14-24-40,31-16-6-15-25-43(46)44-30-28-36-17-7-2-8-18-36)32-29-37-26-27-41(47-34-38-19-9-3-10-20-38)42(33-37)48-35-39-21-11-4-12-22-39/h2-5,7-14,17-24,26-27,33H,6,15-16,25,28-32,34-35H2,1H3/p+1