4-(3-oxidanylidenebut-1-ynyl)benzenecarbonitrile

Systemtic Name: 4-(3-oxidanylidenebut-1-ynyl)benzenecarbonitrile Openeye Name: 4-(3-oxobut-1-ynyl)benzonitrile CAS Name: 4-(3-oxobut-1-ynyl)benzonitrile IUPAC Name: 4-(3-oxobut-1-ynyl)benzonitrile Traditional Name: 4-(3-ketobut-1-ynyl)benzonitrile Formula: C11H7NO MolecularWeight: 169.17938

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C#CC1=CC=C(C=C1)C#N

Isomeric SMILES

CC(=O)C#CC1=CC=C(C=C1)C#N

InChI

InChI=1S/C11H7NO/c1-9(13)2-3-10-4-6-11(8-12)7-5-10/h4-7H,1H3