3-[[2-(hydroxymethyl)phenyl]-(pyridin-3-ylmethyl)amino]propanenitrile

Systemtic Name: 3-[[2-(hydroxymethyl)phenyl]-(pyridin-3-ylmethyl)amino]propanenitrile Openeye Name: 3-[2-(hydroxymethyl)-N-(3-pyridylmethyl)anilino]propanenitrile CAS Name: 3-[2-(hydroxymethyl)-N-(3-pyridinylmethyl)anilino]propanenitrile IUPAC Name: 3-[2-(hydroxymethyl)-N-(pyridin-3-ylmethyl)anilino]propanenitrile Traditional Name: 3-[2-methylol-N-(3-pyridylmethyl)anilino]propionitrile Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CO)N(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

C1=CC=C(C(=C1)CO)N(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C16H17N3O/c17-8-4-10-19(12-14-5-3-9-18-11-14)16-7-2-1-6-15(16)13-20/h1-3,5-7,9,11,20H,4,10,12-13H2