3-(3-oxidanylidenebutyl)benzenecarbonitrile

Systemtic Name: 3-(3-oxidanylidenebutyl)benzenecarbonitrile Openeye Name: 3-(3-oxobutyl)benzonitrile CAS Name: 3-(3-oxobutyl)benzonitrile IUPAC Name: 3-(3-oxobutyl)benzonitrile Traditional Name: 3-(3-ketobutyl)benzonitrile Formula: C11H11NO MolecularWeight: 173.21114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=CC(=C1)C#N

Isomeric SMILES

CC(=O)CCC1=CC=CC(=C1)C#N

InChI

InChI=1S/C11H11NO/c1-9(13)5-6-10-3-2-4-11(7-10)8-12/h2-4,7H,5-6H2,1H3