2-[4-[2-oxidanyl-3-(3-oxidanylpiperidin-1-yl)propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[2-oxidanyl-3-(3-oxidanylpiperidin-1-yl)propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[2-hydroxy-3-(3-hydroxy-1-piperidyl)propoxy]phenyl]acetonitrile CAS Name: 2-[4-[2-hydroxy-3-(3-hydroxy-1-piperidinyl)propoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[2-hydroxy-3-(3-hydroxypiperidin-1-yl)propoxy]phenyl]acetonitrile Traditional Name: 2-[4-[2-hydroxy-3-(3-hydroxypiperidino)propoxy]phenyl]acetonitrile Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(COC2=CC=C(C=C2)CC#N)O)O

Isomeric SMILES

C1CC(CN(C1)CC(COC2=CC=C(C=C2)CC#N)O)O

InChI

InChI=1S/C16H22N2O3/c17-8-7-13-3-5-16(6-4-13)21-12-15(20)11-18-9-1-2-14(19)10-18/h3-6,14-15,19-20H,1-2,7,9-12H2