2-[4-[3-(3,5-dimethylpiperidin-1-yl)-2-oxidanyl-propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[3-(3,5-dimethylpiperidin-1-yl)-2-oxidanyl-propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[3-(3,5-dimethyl-1-piperidyl)-2-hydroxy-propoxy]phenyl]acetonitrile CAS Name: 2-[4-[3-(3,5-dimethyl-1-piperidinyl)-2-hydroxypropoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[3-(3,5-dimethylpiperidin-1-yl)-2-hydroxypropoxy]phenyl]acetonitrile Traditional Name: 2-[4-[3-(3,5-dimethylpiperidino)-2-hydroxy-propoxy]phenyl]acetonitrile Formula: C18H26N2O2 MolecularWeight: 302.41124

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CC(COC2=CC=C(C=C2)CC#N)O)C

Isomeric SMILES

CC1CC(CN(C1)CC(COC2=CC=C(C=C2)CC#N)O)C

InChI

InChI=1S/C18H26N2O2/c1-14-9-15(2)11-20(10-14)12-17(21)13-22-18-5-3-16(4-6-18)7-8-19/h3-6,14-15,17,21H,7,9-13H2,1-2H3