3-iodanyl-6-[2-(4-pentylcyclohexyl)ethyl]benzene-1,2-dicarbonitrile

Systemtic Name: 3-iodanyl-6-[2-(4-pentylcyclohexyl)ethyl]benzene-1,2-dicarbonitrile Openeye Name: 3-iodo-6-[2-(4-pentylcyclohexyl)ethyl]phthalonitrile CAS Name: 3-iodo-6-[2-(4-pentylcyclohexyl)ethyl]benzene-1,2-dicarbonitrile IUPAC Name: 3-iodo-6-[2-(4-pentylcyclohexyl)ethyl]benzene-1,2-dicarbonitrile Traditional Name: 3-[2-(4-amylcyclohexyl)ethyl]-6-iodo-phthalonitrile Formula: C21H27IN2 MolecularWeight: 434.35695

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCC2=C(C(=C(C=C2)I)C#N)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)CCC2=C(C(=C(C=C2)I)C#N)C#N

InChI

InChI=1S/C21H27IN2/c1-2-3-4-5-16-6-8-17(9-7-16)10-11-18-12-13-21(22)20(15-24)19(18)14-23/h12-13,16-17H,2-11H2,1H3