5-(1-ethyl-4-bicyclo[2.2.2]octanyl)-2-propoxy-benzenecarbonitrile

Systemtic Name: 5-(1-ethyl-4-bicyclo[2.2.2]octanyl)-2-propoxy-benzenecarbonitrile Openeye Name: 5-(1-ethyl-4-bicyclo[2.2.2]octanyl)-2-propoxy-benzonitrile CAS Name: 5-(1-ethyl-4-bicyclo[2.2.2]octanyl)-2-propoxybenzonitrile IUPAC Name: 5-(1-ethyl-4-bicyclo[2.2.2]octanyl)-2-propoxybenzonitrile Traditional Name: 5-(1-ethyl-4-bicyclo[2.2.2]octanyl)-2-propoxy-benzonitrile Formula: C20H27NO MolecularWeight: 297.43448

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C23CCC(CC2)(CC3)CC)C#N

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C23CCC(CC2)(CC3)CC)C#N

InChI

InChI=1S/C20H27NO/c1-3-13-22-18-6-5-17(14-16(18)15-21)20-10-7-19(4-2,8-11-20)9-12-20/h5-6,14H,3-4,7-13H2,1-2H3