4-[3-(3,8-diazabicyclo[3.2.1]octan-8-yl)-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-(3,8-diazabicyclo[3.2.1]octan-8-yl)-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 4-[3-(3,8-diazabicyclo[3.2.1]octan-8-yl)-2-hydroxy-propoxy]benzonitrile CAS Name: 4-[3-(3,8-diazabicyclo[3.2.1]octan-8-yl)-2-hydroxypropoxy]benzonitrile IUPAC Name: 4-[3-(3,8-diazabicyclo[3.2.1]octan-8-yl)-2-hydroxypropoxy]benzonitrile Traditional Name: 4-[3-(3,8-diazabicyclo[3.2.1]octan-8-yl)-2-hydroxy-propoxy]benzonitrile Formula: C16H21N3O2 MolecularWeight: 287.35684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2CNCC1N2CC(COC3=CC=C(C=C3)C#N)O

Isomeric SMILES

C1CC2CNCC1N2CC(COC3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C16H21N3O2/c17-7-12-1-5-16(6-2-12)21-11-15(20)10-19-13-3-4-14(19)9-18-8-13/h1-2,5-6,13-15,18,20H,3-4,8-11H2