2-[4-[3-[4-(furan-2-ylmethyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[3-[4-(furan-2-ylmethyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[3-[4-(2-furylmethyl)piperazin-1-yl]-2-hydroxy-propoxy]phenyl]acetonitrile CAS Name: 2-[4-[3-[4-(2-furanylmethyl)-1-piperazinyl]-2-hydroxypropoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[3-[4-(furan-2-ylmethyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]acetonitrile Traditional Name: 2-[4-[3-[4-(2-furfuryl)piperazino]-2-hydroxy-propoxy]phenyl]acetonitrile Formula: C20H25N3O3 MolecularWeight: 355.4308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CO2)CC(COC3=CC=C(C=C3)CC#N)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CO2)CC(COC3=CC=C(C=C3)CC#N)O

InChI

InChI=1S/C20H25N3O3/c21-8-7-17-3-5-19(6-4-17)26-16-18(24)14-22-9-11-23(12-10-22)15-20-2-1-13-25-20/h1-6,13,18,24H,7,9-12,14-16H2