5-tert-butyl-2-oxabicyclo[2.2.2]octa-1(6),4,7-trien-3-one; 2-phenylmethoxynaphthalene

Systemtic Name: 5-tert-butyl-2-oxabicyclo[2.2.2]octa-1(6),4,7-trien-3-one; 2-phenylmethoxynaphthalene Openeye Name: 2-benzyloxynaphthalene; 5-tert-butyl-2-oxabicyclo[2.2.2]octa-1(6),4,7-trien-3-one CAS Name: 5-tert-butyl-2-oxabicyclo[2.2.2]octa-1(6),4,7-trien-3-one; 2-phenylmethoxynaphthalene IUPAC Name: 5-tert-butyl-2-oxabicyclo[2.2.2]octa-1(6),4,7-trien-3-one; 2-phenylmethoxynaphthalene Traditional Name: 2-benzoxynaphthalene; 5-tert-butyl-2-oxabicyclo[2.2.2]octa-1(6),4,7-trien-3-one Formula: C28H26O3 MolecularWeight: 410.50424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C=CC(=C1)OC2=O.C1=CC=C(C=C1)COC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)(C)C1=C2C=CC(=C1)OC2=O.C1=CC=C(C=C1)COC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C17H14O.C11H12O2/c1-2-6-14(7-3-1)13-18-17-11-10-15-8-4-5-9-16(15)12-17;1-11(2,3)9-6-7-4-5-8(9)10(12)13-7/h1-12H,13H2;4-6H,1-3H3