2-(bromomethyl)-2-(2-ethoxyphenyl)heptanenitrile

Systemtic Name: 2-(bromomethyl)-2-(2-ethoxyphenyl)heptanenitrile Openeye Name: 2-(bromomethyl)-2-(2-ethoxyphenyl)heptanenitrile CAS Name: 2-(bromomethyl)-2-(2-ethoxyphenyl)heptanenitrile IUPAC Name: 2-(bromomethyl)-2-(2-ethoxyphenyl)heptanenitrile Traditional Name: 2-(bromomethyl)-2-o-phenetyl-enanthonitrile Formula: C16H22BrNO MolecularWeight: 324.25598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CBr)(C#N)C1=CC=CC=C1OCC

Isomeric SMILES

CCCCCC(CBr)(C#N)C1=CC=CC=C1OCC

InChI

InChI=1S/C16H22BrNO/c1-3-5-8-11-16(12-17,13-18)14-9-6-7-10-15(14)19-4-2/h6-7,9-10H,3-5,8,11-12H2,1-2H3