2-[4-(3-bromanylpropoxy)phenyl]ethanenitrile

Systemtic Name: 2-[4-(3-bromanylpropoxy)phenyl]ethanenitrile Openeye Name: 2-[4-(3-bromopropoxy)phenyl]acetonitrile CAS Name: 2-[4-(3-bromopropoxy)phenyl]acetonitrile IUPAC Name: 2-[4-(3-bromopropoxy)phenyl]acetonitrile Traditional Name: 2-[4-(3-bromopropoxy)phenyl]acetonitrile Formula: C11H12BrNO MolecularWeight: 254.12308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)OCCCBr

Isomeric SMILES

C1=CC(=CC=C1CC#N)OCCCBr

InChI

InChI=1S/C11H12BrNO/c12-7-1-9-14-11-4-2-10(3-5-11)6-8-13/h2-5H,1,6-7,9H2