3-(4-chlorophenyl)-3-methyl-pentanenitrile

Systemtic Name: 3-(4-chlorophenyl)-3-methyl-pentanenitrile Openeye Name: 3-(4-chlorophenyl)-3-methyl-pentanenitrile CAS Name: 3-(4-chlorophenyl)-3-methylpentanenitrile IUPAC Name: 3-(4-chlorophenyl)-3-methylpentanenitrile Traditional Name: 3-(4-chlorophenyl)-3-methyl-valeronitrile Formula: C12H14ClN MolecularWeight: 207.69926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC#N)C1=CC=C(C=C1)Cl

Isomeric SMILES

CCC(C)(CC#N)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H14ClN/c1-3-12(2,8-9-14)10-4-6-11(13)7-5-10/h4-7H,3,8H2,1-2H3