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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CBr)OCCCC#N

Isomeric SMILES

CCOC1=C(C=CC(=C1)CBr)OCCCC#N

InChI

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