1,2-dimethyl-1-[3-(2-methylphenoxy)-3-phenyl-propyl]piperidin-1-ium bromide

Systemtic Name: 1,2-dimethyl-1-[3-(2-methylphenoxy)-3-phenyl-propyl]piperidin-1-ium bromide Openeye Name: 1,2-dimethyl-1-[3-(2-methylphenoxy)-3-phenyl-propyl]piperidin-1-ium bromide CAS Name: 1,2-dimethyl-1-[3-(2-methylphenoxy)-3-phenylpropyl]piperidin-1-ium bromide IUPAC Name: 1,2-dimethyl-1-[3-(2-methylphenoxy)-3-phenylpropyl]piperidin-1-ium bromide Traditional Name: 1,2-dimethyl-1-[3-(2-methylphenoxy)-3-phenyl-propyl]piperidin-1-ium bromide Formula: C23H32BrNO MolecularWeight: 418.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[N+]1(C)CCC(C2=CC=CC=C2)OC3=CC=CC=C3C.[Br-]

Isomeric SMILES

CC1CCCC[N+]1(C)CCC(C2=CC=CC=C2)OC3=CC=CC=C3C.[Br-]

InChI

InChI=1S/C23H32NO.BrH/c1-19-11-7-8-15-22(19)25-23(21-13-5-4-6-14-21)16-18-24(3)17-10-9-12-20(24)2;/h4-8,11,13-15,20,23H,9-10,12,16-18H2,1-3H3;1H/q+1;/p-1