5-(2-iodanylphenyl)-2,2-dimethyl-pentanenitrile

Systemtic Name: 5-(2-iodanylphenyl)-2,2-dimethyl-pentanenitrile Openeye Name: 5-(2-iodophenyl)-2,2-dimethyl-pentanenitrile CAS Name: 5-(2-iodophenyl)-2,2-dimethylpentanenitrile IUPAC Name: 5-(2-iodophenyl)-2,2-dimethylpentanenitrile Traditional Name: 5-(2-iodophenyl)-2,2-dimethyl-valeronitrile Formula: C13H16IN MolecularWeight: 313.17731

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC1=CC=CC=C1I)C#N

Isomeric SMILES

CC(C)(CCCC1=CC=CC=C1I)C#N

InChI

InChI=1S/C13H16IN/c1-13(2,10-15)9-5-7-11-6-3-4-8-12(11)14/h3-4,6,8H,5,7,9H2,1-2H3