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

Systemtic Name: 2-chloranyl-4-(1-propyl-4-bicyclo[2.2.2]octanyl)benzenecarbonitrile Openeye Name: 2-chloro-4-(1-propyl-4-bicyclo[2.2.2]octanyl)benzonitrile CAS Name: 2-chloro-4-(1-propyl-4-bicyclo[2.2.2]octanyl)benzonitrile IUPAC Name: 2-chloro-4-(1-propyl-4-bicyclo[2.2.2]octanyl)benzonitrile Traditional Name: 2-chloro-4-(1-propyl-4-bicyclo[2.2.2]octanyl)benzonitrile Formula: C18H22ClN MolecularWeight: 287.82698

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Descriptors Computed from Structure

Canonical SMILES:

CCCC12CCC(CC1)(CC2)C3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CCCC12CCC(CC1)(CC2)C3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H22ClN/c1-2-5-17-6-9-18(10-7-17,11-8-17)15-4-3-14(13-20)16(19)12-15/h3-4,12H,2,5-11H2,1H3