4-[4-(4-ethanoylcyclohexyl)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(4-ethanoylcyclohexyl)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(4-acetylcyclohexyl)phenyl]benzonitrile CAS Name: 4-[4-(4-acetylcyclohexyl)phenyl]benzonitrile IUPAC Name: 4-[4-(4-acetylcyclohexyl)phenyl]benzonitrile Traditional Name: 4-[4-(4-acetylcyclohexyl)phenyl]benzonitrile Formula: C21H21NO MolecularWeight: 303.39754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(=O)C1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H21NO/c1-15(23)17-6-8-19(9-7-17)21-12-10-20(11-13-21)18-4-2-16(14-22)3-5-18/h2-5,10-13,17,19H,6-9H2,1H3