2-[4-[(E)-4-oxidanylidenebut-1-enyl]cyclohexyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(E)-4-oxidanylidenebut-1-enyl]cyclohexyl]benzenecarbonitrile Openeye Name: 2-[4-[(E)-4-oxobut-1-enyl]cyclohexyl]benzonitrile CAS Name: 2-[4-[(E)-4-oxobut-1-enyl]cyclohexyl]benzonitrile IUPAC Name: 2-[4-[(E)-4-oxobut-1-enyl]cyclohexyl]benzonitrile Traditional Name: 2-[4-[(E)-4-ketobut-1-enyl]cyclohexyl]benzonitrile Formula: C17H19NO MolecularWeight: 253.33886

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C=CCC=O)C2=CC=CC=C2C#N

Isomeric SMILES

C1CC(CCC1/C=C/CC=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C17H19NO/c18-13-16-6-1-2-7-17(16)15-10-8-14(9-11-15)5-3-4-12-19/h1-3,5-7,12,14-15H,4,8-11H2/b5-3+