4-[2-ethoxy-6-(hydroxymethyl)phenoxy]butanenitrile

Systemtic Name: 4-[2-ethoxy-6-(hydroxymethyl)phenoxy]butanenitrile Openeye Name: 4-[2-ethoxy-6-(hydroxymethyl)phenoxy]butanenitrile CAS Name: 4-[2-ethoxy-6-(hydroxymethyl)phenoxy]butanenitrile IUPAC Name: 4-[2-ethoxy-6-(hydroxymethyl)phenoxy]butanenitrile Traditional Name: 4-(2-ethoxy-6-methylol-phenoxy)butyronitrile Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OCCCC#N)CO

Isomeric SMILES

CCOC1=CC=CC(=C1OCCCC#N)CO

InChI

InChI=1S/C13H17NO3/c1-2-16-12-7-5-6-11(10-15)13(12)17-9-4-3-8-14/h5-7,15H,2-4,9-10H2,1H3