3-iodanyl-4-[4-(4-pentylcyclohexyl)phenyl]benzenecarbonitrile

Systemtic Name: 3-iodanyl-4-[4-(4-pentylcyclohexyl)phenyl]benzenecarbonitrile Openeye Name: 3-iodo-4-[4-(4-pentylcyclohexyl)phenyl]benzonitrile CAS Name: 3-iodo-4-[4-(4-pentylcyclohexyl)phenyl]benzonitrile IUPAC Name: 3-iodo-4-[4-(4-pentylcyclohexyl)phenyl]benzonitrile Traditional Name: 4-[4-(4-amylcyclohexyl)phenyl]-3-iodo-benzonitrile Formula: C24H28IN MolecularWeight: 457.39029

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C=C(C=C3)C#N)I

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C=C(C=C3)C#N)I

InChI

InChI=1S/C24H28IN/c1-2-3-4-5-18-6-9-20(10-7-18)21-11-13-22(14-12-21)23-15-8-19(17-26)16-24(23)25/h8,11-16,18,20H,2-7,9-10H2,1H3