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

Systemtic Name: 1-butyl-4-[2-(4-ethylphenyl)ethynyl]bicyclo[2.2.2]octane Openeye Name: 1-butyl-4-[2-(4-ethylphenyl)ethynyl]bicyclo[2.2.2]octane CAS Name: 1-butyl-4-[2-(4-ethylphenyl)ethynyl]bicyclo[2.2.2]octane IUPAC Name: 1-butyl-4-[2-(4-ethylphenyl)ethynyl]bicyclo[2.2.2]octane Traditional Name: 1-butyl-4-[2-(4-ethylphenyl)ethynyl]bicyclo[2.2.2]octane Formula: C22H30 MolecularWeight: 294.4736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30/c1-3-5-11-21-13-16-22(17-14-21,18-15-21)12-10-20-8-6-19(4-2)7-9-20/h6-9H,3-5,11,13-18H2,1-2H3