1-tert-butyl-4-(3-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane

Systemtic Name: 1-tert-butyl-4-(3-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane Openeye Name: 1-tert-butyl-4-(3-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane CAS Name: 1-tert-butyl-4-(3-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane IUPAC Name: 1-tert-butyl-4-(3-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane Traditional Name: 1-tert-butyl-4-(3-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C12COC(OC1)(OC2)C3=CC=CC(=C3)C#C

Isomeric SMILES

CC(C)(C)C12COC(OC1)(OC2)C3=CC=CC(=C3)C#C

InChI

InChI=1S/C17H20O3/c1-5-13-7-6-8-14(9-13)17-18-10-16(11-19-17,12-20-17)15(2,3)4/h1,6-9H,10-12H2,2-4H3