2-chloranyl-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)benzenecarbonitrile Openeye Name: 2-chloro-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)benzonitrile CAS Name: 2-chloro-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)benzonitrile IUPAC Name: 2-chloro-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)benzonitrile Traditional Name: 2-chloro-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)benzonitrile Formula: C22H30ClN MolecularWeight: 343.9333

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC12CCC(CC1)(CC2)C3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CCCCCCCC12CCC(CC1)(CC2)C3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C22H30ClN/c1-2-3-4-5-6-9-21-10-13-22(14-11-21,15-12-21)19-8-7-18(17-24)20(23)16-19/h7-8,16H,2-6,9-15H2,1H3