4-[2,5-bis(chloranyl)pentanoyl]benzenecarbonitrile

Systemtic Name: 4-[2,5-bis(chloranyl)pentanoyl]benzenecarbonitrile Openeye Name: 4-(2,5-dichloropentanoyl)benzonitrile CAS Name: 4-(2,5-dichloro-1-oxopentyl)benzonitrile IUPAC Name: 4-(2,5-dichloropentanoyl)benzonitrile Traditional Name: 4-(2,5-dichloropentanoyl)benzonitrile Formula: C12H11Cl2NO MolecularWeight: 256.12784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)C(CCCCl)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)C(CCCCl)Cl

InChI

InChI=1S/C12H11Cl2NO/c13-7-1-2-11(14)12(16)10-5-3-9(8-15)4-6-10/h3-6,11H,1-2,7H2