4-[2-(3-oxidanylidenepropyl)phenyl]benzenecarbonitrile

Systemtic Name: 4-[2-(3-oxidanylidenepropyl)phenyl]benzenecarbonitrile Openeye Name: 4-[2-(3-oxopropyl)phenyl]benzonitrile CAS Name: 4-[2-(3-oxopropyl)phenyl]benzonitrile IUPAC Name: 4-[2-(3-oxopropyl)phenyl]benzonitrile Traditional Name: 4-[2-(3-ketopropyl)phenyl]benzonitrile Formula: C16H13NO MolecularWeight: 235.28052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCC=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CCC=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H13NO/c17-12-13-7-9-15(10-8-13)16-6-2-1-4-14(16)5-3-11-18/h1-2,4,6-11H,3,5H2