2-chloranyl-5-ethanoyl-benzenecarbonitrile

Systemtic Name: 2-chloranyl-5-ethanoyl-benzenecarbonitrile Openeye Name: 5-acetyl-2-chloro-benzonitrile CAS Name: 5-acetyl-2-chlorobenzonitrile IUPAC Name: 5-acetyl-2-chlorobenzonitrile Traditional Name: 5-acetyl-2-chloro-benzonitrile Formula: C9H6ClNO MolecularWeight: 179.60304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6ClNO/c1-6(12)7-2-3-9(10)8(4-7)5-11/h2-4H,1H3