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

Systemtic Name: 4-[2-(bromomethyl)-6-ethoxy-phenoxy]butanenitrile Openeye Name: 4-[2-(bromomethyl)-6-ethoxy-phenoxy]butanenitrile CAS Name: 4-[2-(bromomethyl)-6-ethoxyphenoxy]butanenitrile IUPAC Name: 4-[2-(bromomethyl)-6-ethoxyphenoxy]butanenitrile Traditional Name: 4-[2-(bromomethyl)-6-ethoxy-phenoxy]butyronitrile Formula: C13H16BrNO2 MolecularWeight: 298.17564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrNO2/c1-2-16-12-7-5-6-11(10-14)13(12)17-9-4-3-8-15/h5-7H,2-4,9-10H2,1H3