3-[[4-(hydroxymethyl)phenyl]-(pyridin-3-ylmethyl)amino]propanenitrile

Systemtic Name: 3-[[4-(hydroxymethyl)phenyl]-(pyridin-3-ylmethyl)amino]propanenitrile Openeye Name: 3-[4-(hydroxymethyl)-N-(3-pyridylmethyl)anilino]propanenitrile CAS Name: 3-[4-(hydroxymethyl)-N-(3-pyridinylmethyl)anilino]propanenitrile IUPAC Name: 3-[4-(hydroxymethyl)-N-(pyridin-3-ylmethyl)anilino]propanenitrile Traditional Name: 3-[4-methylol-N-(3-pyridylmethyl)anilino]propionitrile Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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