2-[[4-(bromomethyl)phenyl]methyl]butanenitrile

Systemtic Name: 2-[[4-(bromomethyl)phenyl]methyl]butanenitrile Openeye Name: 2-[[4-(bromomethyl)phenyl]methyl]butanenitrile CAS Name: 2-[[4-(bromomethyl)phenyl]methyl]butanenitrile IUPAC Name: 2-[[4-(bromomethyl)phenyl]methyl]butanenitrile Traditional Name: 2-[4-(bromomethyl)benzyl]butyronitrile Formula: C12H14BrN MolecularWeight: 252.15026

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=C(C=C1)CBr)C#N

Isomeric SMILES

CCC(CC1=CC=C(C=C1)CBr)C#N

InChI

InChI=1S/C12H14BrN/c1-2-10(9-14)7-11-3-5-12(8-13)6-4-11/h3-6,10H,2,7-8H2,1H3