3-(4-cyanobutanoyl)benzenecarbonitrile

Systemtic Name: 3-(4-cyanobutanoyl)benzenecarbonitrile Openeye Name: 3-(4-cyanobutanoyl)benzonitrile CAS Name: 3-(4-cyano-1-oxobutyl)benzonitrile IUPAC Name: 3-(4-cyanobutanoyl)benzonitrile Traditional Name: 3-(4-cyanobutanoyl)benzonitrile Formula: C12H10N2O MolecularWeight: 198.2206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N2O/c13-7-2-1-6-12(15)11-5-3-4-10(8-11)9-14/h3-5,8H,1-2,6H2