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

Systemtic Name: diethyl-methyl-[2-[4-[(2-phenylmethoxyphenyl)carbonylamino]phenyl]carbonyloxyethyl]azanium bromide Openeye Name: 2-[4-[(2-benzyloxybenzoyl)amino]benzoyl]oxyethyl-diethyl-methyl-ammonium bromide CAS Name: diethyl-methyl-[2-[oxo-[4-[[oxo-(2-phenylmethoxyphenyl)methyl]amino]phenyl]methoxy]ethyl]ammonium bromide IUPAC Name: diethyl-methyl-[2-[4-[(2-phenylmethoxybenzoyl)amino]benzoyl]oxyethyl]azanium bromide Traditional Name: 2-[4-[(2-benzoxybenzoyl)amino]benzoyl]oxyethyl-diethyl-methyl-ammonium bromide Formula: C28H33BrN2O4 MolecularWeight: 541.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2OCC3=CC=CC=C3.[Br-]

Isomeric SMILES

CC[N+](C)(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2OCC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C28H32N2O4.BrH/c1-4-30(3,5-2)19-20-33-28(32)23-15-17-24(18-16-23)29-27(31)25-13-9-10-14-26(25)34-21-22-11-7-6-8-12-22;/h6-18H,4-5,19-21H2,1-3H3;1H