diethyl-methyl-[2-[4-[(3-octoxyphenyl)carbonylamino]phenyl]carbonyloxyethyl]azanium bromide

Systemtic Name: diethyl-methyl-[2-[4-[(3-octoxyphenyl)carbonylamino]phenyl]carbonyloxyethyl]azanium bromide Openeye Name: diethyl-methyl-[2-[4-[(3-octoxybenzoyl)amino]benzoyl]oxyethyl]ammonium bromide CAS Name: diethyl-methyl-[2-[[4-[[(3-octoxyphenyl)-oxomethyl]amino]phenyl]-oxomethoxy]ethyl]ammonium bromide IUPAC Name: diethyl-methyl-[2-[4-[(3-octoxybenzoyl)amino]benzoyl]oxyethyl]azanium bromide Traditional Name: diethyl-methyl-[2-[4-[(3-octoxybenzoyl)amino]benzoyl]oxyethyl]ammonium bromide Formula: C29H43BrN2O4 MolecularWeight: 563.56672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)OCC[N+](C)(CC)CC.[Br-]

Isomeric SMILES

CCCCCCCCOC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)OCC[N+](C)(CC)CC.[Br-]

InChI

InChI=1S/C29H42N2O4.BrH/c1-5-8-9-10-11-12-21-34-27-15-13-14-25(23-27)28(32)30-26-18-16-24(17-19-26)29(33)35-22-20-31(4,6-2)7-3;/h13-19,23H,5-12,20-22H2,1-4H3;1H