2-[2,5-bis(chloranyl)phenyl]carbonylbutanenitrile

Systemtic Name: 2-[2,5-bis(chloranyl)phenyl]carbonylbutanenitrile Openeye Name: 2-(2,5-dichlorobenzoyl)butanenitrile CAS Name: 2-[(2,5-dichlorophenyl)-oxomethyl]butanenitrile IUPAC Name: 2-(2,5-dichlorobenzoyl)butanenitrile Traditional Name: 2-(2,5-dichlorobenzoyl)butyronitrile Formula: C11H9Cl2NO MolecularWeight: 242.10126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9Cl2NO/c1-2-7(6-14)11(15)9-5-8(12)3-4-10(9)13/h3-5,7H,2H2,1H3