1,1-dimethyl-4-[4-(2-methylpropoxy)phenyl]piperidin-1-ium-4-carbonitrile bromide

Systemtic Name: 1,1-dimethyl-4-[4-(2-methylpropoxy)phenyl]piperidin-1-ium-4-carbonitrile bromide Openeye Name: 4-(4-isobutoxyphenyl)-1,1-dimethyl-piperidin-1-ium-4-carbonitrile bromide CAS Name: 1,1-dimethyl-4-[4-(2-methylpropoxy)phenyl]-4-piperidin-1-iumcarbonitrile bromide IUPAC Name: 1,1-dimethyl-4-[4-(2-methylpropoxy)phenyl]piperidin-1-ium-4-carbonitrile bromide Traditional Name: 4-(4-isobutoxyphenyl)-1,1-dimethyl-piperidin-1-ium-4-carbonitrile bromide Formula: C18H27BrN2O MolecularWeight: 367.32378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C2(CC[N+](CC2)(C)C)C#N.[Br-]

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C2(CC[N+](CC2)(C)C)C#N.[Br-]

InChI

InChI=1S/C18H27N2O.BrH/c1-15(2)13-21-17-7-5-16(6-8-17)18(14-19)9-11-20(3,4)12-10-18;/h5-8,15H,9-13H2,1-4H3;1H/q+1;/p-1