5-ethanoylbicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile

Systemtic Name: 5-ethanoylbicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile Openeye Name: 5-acetylbicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile CAS Name: 5-acetyl-7-bicyclo[4.2.0]octa-1(6),2,4-trienecarbonitrile IUPAC Name: 5-acetylbicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile Traditional Name: 5-acetylbicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile Formula: C11H9NO MolecularWeight: 171.19526

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2C(CC2=CC=C1)C#N

Isomeric SMILES

CC(=O)C1=C2C(CC2=CC=C1)C#N

InChI

InChI=1S/C11H9NO/c1-7(13)10-4-2-3-8-5-9(6-12)11(8)10/h2-4,9H,5H2,1H3