1-butyl-4-[2-(4-propoxyphenyl)ethynyl]bicyclo[2.2.2]octane

Systemtic Name: 1-butyl-4-[2-(4-propoxyphenyl)ethynyl]bicyclo[2.2.2]octane Openeye Name: 1-butyl-4-[2-(4-propoxyphenyl)ethynyl]bicyclo[2.2.2]octane CAS Name: 1-butyl-4-[2-(4-propoxyphenyl)ethynyl]bicyclo[2.2.2]octane IUPAC Name: 1-butyl-4-[2-(4-propoxyphenyl)ethynyl]bicyclo[2.2.2]octane Traditional Name: 1-butyl-4-[2-(4-propoxyphenyl)ethynyl]bicyclo[2.2.2]octane Formula: C23H32O MolecularWeight: 324.49958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC12CCC(CC1)(CC2)C#CC3=CC=C(C=C3)OCCC

Isomeric SMILES

CCCCC12CCC(CC1)(CC2)C#CC3=CC=C(C=C3)OCCC

InChI

InChI=1S/C23H32O/c1-3-5-11-22-13-16-23(17-14-22,18-15-22)12-10-20-6-8-21(9-7-20)24-19-4-2/h6-9H,3-5,11,13-19H2,1-2H3