2-[6-(hydroxymethyl)-1-methyl-isoquinolin-3-yl]propanenitrile

Systemtic Name: 2-[6-(hydroxymethyl)-1-methyl-isoquinolin-3-yl]propanenitrile Openeye Name: 2-[6-(hydroxymethyl)-1-methyl-3-isoquinolyl]propanenitrile CAS Name: 2-[6-(hydroxymethyl)-1-methyl-3-isoquinolinyl]propanenitrile IUPAC Name: 2-[6-(hydroxymethyl)-1-methylisoquinolin-3-yl]propanenitrile Traditional Name: 2-(1-methyl-6-methylol-3-isoquinolyl)propionitrile Formula: C14H14N2O MolecularWeight: 226.27376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=CC2=CC(=N1)C(C)C#N)CO

Isomeric SMILES

CC1=C2C=CC(=CC2=CC(=N1)C(C)C#N)CO

InChI

InChI=1S/C14H14N2O/c1-9(7-15)14-6-12-5-11(8-17)3-4-13(12)10(2)16-14/h3-6,9,17H,8H2,1-2H3