5,5-dimethoxy-3-phenyl-pentanenitrile

Systemtic Name: 5,5-dimethoxy-3-phenyl-pentanenitrile Openeye Name: 5,5-dimethoxy-3-phenyl-pentanenitrile CAS Name: 5,5-dimethoxy-3-phenylpentanenitrile IUPAC Name: 5,5-dimethoxy-3-phenylpentanenitrile Traditional Name: 5,5-dimethoxy-3-phenyl-valeronitrile Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC(CC#N)C1=CC=CC=C1)OC

Isomeric SMILES

COC(CC(CC#N)C1=CC=CC=C1)OC

InChI

InChI=1S/C13H17NO2/c1-15-13(16-2)10-12(8-9-14)11-6-4-3-5-7-11/h3-7,12-13H,8,10H2,1-2H3