2-[4-(5-chloranylpentoxy)phenyl]ethanenitrile

Systemtic Name: 2-[4-(5-chloranylpentoxy)phenyl]ethanenitrile Openeye Name: 2-[4-(5-chloropentoxy)phenyl]acetonitrile CAS Name: 2-[4-(5-chloropentoxy)phenyl]acetonitrile IUPAC Name: 2-[4-(5-chloropentoxy)phenyl]acetonitrile Traditional Name: 2-[4-(5-chloropentoxy)phenyl]acetonitrile Formula: C13H16ClNO MolecularWeight: 237.72524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNO/c14-9-2-1-3-11-16-13-6-4-12(5-7-13)8-10-15/h4-7H,1-3,8-9,11H2