2-[4-[2-[3-(hydroxymethyl)piperidin-1-yl]ethoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[2-[3-(hydroxymethyl)piperidin-1-yl]ethoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[2-[3-(hydroxymethyl)-1-piperidyl]ethoxy]phenyl]acetonitrile CAS Name: 2-[4-[2-[3-(hydroxymethyl)-1-piperidinyl]ethoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[2-[3-(hydroxymethyl)piperidin-1-yl]ethoxy]phenyl]acetonitrile Traditional Name: 2-[4-[2-(3-methylolpiperidino)ethoxy]phenyl]acetonitrile Formula: C16H22N2O2 MolecularWeight: 274.35808

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCOC2=CC=C(C=C2)CC#N)CO

Isomeric SMILES

C1CC(CN(C1)CCOC2=CC=C(C=C2)CC#N)CO

InChI

InChI=1S/C16H22N2O2/c17-8-7-14-3-5-16(6-4-14)20-11-10-18-9-1-2-15(12-18)13-19/h3-6,15,19H,1-2,7,9-13H2