2-(1-butyl-4-bicyclo[2.2.2]octanyl)-6-pentoxy-benzenecarbonitrile

Systemtic Name: 2-(1-butyl-4-bicyclo[2.2.2]octanyl)-6-pentoxy-benzenecarbonitrile Openeye Name: 2-(1-butyl-4-bicyclo[2.2.2]octanyl)-6-pentoxy-benzonitrile CAS Name: 2-(1-butyl-4-bicyclo[2.2.2]octanyl)-6-pentoxybenzonitrile IUPAC Name: 2-(1-butyl-4-bicyclo[2.2.2]octanyl)-6-pentoxybenzonitrile Traditional Name: 2-amoxy-6-(1-butyl-4-bicyclo[2.2.2]octanyl)benzonitrile Formula: C24H35NO MolecularWeight: 353.5408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1C#N)C23CCC(CC2)(CC3)CCCC

Isomeric SMILES

CCCCCOC1=CC=CC(=C1C#N)C23CCC(CC2)(CC3)CCCC

InChI

InChI=1S/C24H35NO/c1-3-5-7-18-26-22-10-8-9-21(20(22)19-25)24-15-12-23(13-16-24,14-17-24)11-6-4-2/h8-10H,3-7,11-18H2,1-2H3