3-[(E)-2-methyl-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-2-methyl-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 3-[(E)-2-methyl-3-oxo-prop-1-enyl]benzonitrile CAS Name: 3-[(E)-2-methyl-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 3-[(E)-2-methyl-3-oxoprop-1-enyl]benzonitrile Traditional Name: 3-[(E)-3-keto-2-methyl-prop-1-enyl]benzonitrile Formula: C11H9NO MolecularWeight: 171.19526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C\C1=CC=CC(=C1)C#N)/C=O

InChI

InChI=1S/C11H9NO/c1-9(8-13)5-10-3-2-4-11(6-10)7-12/h2-6,8H,1H3/b9-5+