2-(4-piperidin-1-ium-1-ylbutoxy)benzenecarbonitrile

Systemtic Name: 2-(4-piperidin-1-ium-1-ylbutoxy)benzenecarbonitrile Openeye Name: 2-(4-piperidin-1-ium-1-ylbutoxy)benzonitrile CAS Name: 2-[4-(1-piperidin-1-iumyl)butoxy]benzonitrile IUPAC Name: 2-(4-piperidin-1-ium-1-ylbutoxy)benzonitrile Traditional Name: 2-(4-piperidin-1-ium-1-ylbutoxy)benzonitrile Formula: C16H23N2O+ MolecularWeight: 259.36662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCCOC2=CC=CC=C2C#N

Isomeric SMILES

C1CC[NH+](CC1)CCCCOC2=CC=CC=C2C#N

InChI

InChI=1S/C16H22N2O/c17-14-15-8-2-3-9-16(15)19-13-7-6-12-18-10-4-1-5-11-18/h2-3,8-9H,1,4-7,10-13H2/p+1