3-[4-oxidanylbutyl(pyridin-3-ylmethyl)amino]propanenitrile

Systemtic Name: 3-[4-oxidanylbutyl(pyridin-3-ylmethyl)amino]propanenitrile Openeye Name: 3-[4-hydroxybutyl(3-pyridylmethyl)amino]propanenitrile CAS Name: 3-[4-hydroxybutyl(3-pyridinylmethyl)amino]propanenitrile IUPAC Name: 3-[4-hydroxybutyl(pyridin-3-ylmethyl)amino]propanenitrile Traditional Name: 3-[4-hydroxybutyl(3-pyridylmethyl)amino]propionitrile Formula: C13H19N3O MolecularWeight: 233.30946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(CCCCO)CCC#N

Isomeric SMILES

C1=CC(=CN=C1)CN(CCCCO)CCC#N

InChI

InChI=1S/C13H19N3O/c14-6-4-9-16(8-1-2-10-17)12-13-5-3-7-15-11-13/h3,5,7,11,17H,1-2,4,8-10,12H2