2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]ethanenitrile

Systemtic Name: 2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]ethanenitrile Openeye Name: 2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidyl]acetonitrile CAS Name: 2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidinyl]acetonitrile IUPAC Name: 2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]acetonitrile Traditional Name: 2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidyl]acetonitrile Formula: C16H20N2O2 MolecularWeight: 272.3422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC#N)CC2COC3=CC=CC=C3O2

Isomeric SMILES

C1CN(CCC1CC#N)CC2COC3=CC=CC=C3O2

InChI

InChI=1S/C16H20N2O2/c17-8-5-13-6-9-18(10-7-13)11-14-12-19-15-3-1-2-4-16(15)20-14/h1-4,13-14H,5-7,9-12H2