2-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethanenitrile

Systemtic Name: 2-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethanenitrile Openeye Name: 2-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]acetonitrile CAS Name: 2-[4-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]acetonitrile IUPAC Name: 2-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]acetonitrile Traditional Name: 2-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]acetonitrile Formula: C15H21N2O+ MolecularWeight: 245.34004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCOC2=CC=C(C=C2)CC#N

Isomeric SMILES

C1CC[NH+](CC1)CCOC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C15H20N2O/c16-9-8-14-4-6-15(7-5-14)18-13-12-17-10-2-1-3-11-17/h4-7H,1-3,8,10-13H2/p+1