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

Systemtic Name: diethyl-[2-[4-[(2-heptoxyphenyl)carbonylamino]phenyl]carbonyloxyethyl]-methyl-azanium bromide Openeye Name: diethyl-[2-[4-[(2-heptoxybenzoyl)amino]benzoyl]oxyethyl]-methyl-ammonium bromide CAS Name: diethyl-[2-[[4-[[(2-heptoxyphenyl)-oxomethyl]amino]phenyl]-oxomethoxy]ethyl]-methylammonium bromide IUPAC Name: diethyl-[2-[4-[(2-heptoxybenzoyl)amino]benzoyl]oxyethyl]-methylazanium bromide Traditional Name: diethyl-[2-[4-[(2-heptoxybenzoyl)amino]benzoyl]oxyethyl]-methyl-ammonium bromide Formula: C28H41BrN2O4 MolecularWeight: 549.54014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)OCC[N+](C)(CC)CC.[Br-]

Isomeric SMILES

CCCCCCCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)OCC[N+](C)(CC)CC.[Br-]

InChI

InChI=1S/C28H40N2O4.BrH/c1-5-8-9-10-13-21-33-26-15-12-11-14-25(26)27(31)29-24-18-16-23(17-19-24)28(32)34-22-20-30(4,6-2)7-3;/h11-12,14-19H,5-10,13,20-22H2,1-4H3;1H