4-(4-butoxyphenyl)-1,1-dimethyl-piperidin-1-ium-4-carbonitrile

Systemtic Name: 4-(4-butoxyphenyl)-1,1-dimethyl-piperidin-1-ium-4-carbonitrile Openeye Name: 4-(4-butoxyphenyl)-1,1-dimethyl-piperidin-1-ium-4-carbonitrile CAS Name: 4-(4-butoxyphenyl)-1,1-dimethyl-4-piperidin-1-iumcarbonitrile IUPAC Name: 4-(4-butoxyphenyl)-1,1-dimethylpiperidin-1-ium-4-carbonitrile Traditional Name: 4-(4-butoxyphenyl)-1,1-dimethyl-piperidin-1-ium-4-carbonitrile Formula: C18H27N2O+ MolecularWeight: 287.41978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2(CC[N+](CC2)(C)C)C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2(CC[N+](CC2)(C)C)C#N

InChI

InChI=1S/C18H27N2O/c1-4-5-14-21-17-8-6-16(7-9-17)18(15-19)10-12-20(2,3)13-11-18/h6-9H,4-5,10-14H2,1-3H3/q+1