diethyl-methyl-[3-[2-(4-methylphenoxy)phenyl]carbonyloxypropyl]azanium bromide

Systemtic Name: diethyl-methyl-[3-[2-(4-methylphenoxy)phenyl]carbonyloxypropyl]azanium bromide Openeye Name: diethyl-methyl-[3-[2-(4-methylphenoxy)benzoyl]oxypropyl]ammonium bromide CAS Name: diethyl-methyl-[3-[[2-(4-methylphenoxy)phenyl]-oxomethoxy]propyl]ammonium bromide IUPAC Name: diethyl-methyl-[3-[2-(4-methylphenoxy)benzoyl]oxypropyl]azanium bromide Traditional Name: diethyl-methyl-[3-[2-(4-methylphenoxy)benzoyl]oxypropyl]ammonium bromide Formula: C22H30BrNO3 MolecularWeight: 436.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCCOC(=O)C1=CC=CC=C1OC2=CC=C(C=C2)C.[Br-]

Isomeric SMILES

CC[N+](C)(CC)CCCOC(=O)C1=CC=CC=C1OC2=CC=C(C=C2)C.[Br-]

InChI

InChI=1S/C22H30NO3.BrH/c1-5-23(4,6-2)16-9-17-25-22(24)20-10-7-8-11-21(20)26-19-14-12-18(3)13-15-19;/h7-8,10-15H,5-6,9,16-17H2,1-4H3;1H/q+1;/p-1