2-[4-[(1-ethylpiperidin-1-ium-4-yl)amino]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(1-ethylpiperidin-1-ium-4-yl)amino]phenoxy]ethanenitrile Openeye Name: 2-[4-[(1-ethylpiperidin-1-ium-4-yl)amino]phenoxy]acetonitrile CAS Name: 2-[4-[(1-ethyl-4-piperidin-1-iumyl)amino]phenoxy]acetonitrile IUPAC Name: 2-[4-[(1-ethylpiperidin-1-ium-4-yl)amino]phenoxy]acetonitrile Traditional Name: 2-[4-[(1-ethylpiperidin-1-ium-4-yl)amino]phenoxy]acetonitrile Formula: C15H22N3O+ MolecularWeight: 260.35468

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC2=CC=C(C=C2)OCC#N

Isomeric SMILES

CC[NH+]1CCC(CC1)NC2=CC=C(C=C2)OCC#N

InChI

InChI=1S/C15H21N3O/c1-2-18-10-7-14(8-11-18)17-13-3-5-15(6-4-13)19-12-9-16/h3-6,14,17H,2,7-8,10-12H2,1H3/p+1