2-chloranyl-2-(phenylmethyl)pentanedinitrile

Systemtic Name: 2-chloranyl-2-(phenylmethyl)pentanedinitrile Openeye Name: 2-benzyl-2-chloro-pentanedinitrile CAS Name: 2-chloro-2-(phenylmethyl)pentanedinitrile IUPAC Name: 2-benzyl-2-chloropentanedinitrile Traditional Name: 2-benzyl-2-chloro-glutaronitrile Formula: C12H11ClN2 MolecularWeight: 218.68214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClN2/c13-12(10-15,7-4-8-14)9-11-5-2-1-3-6-11/h1-3,5-6H,4,7,9H2