3-tert-butyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 1-[2-oxidanyl-6-(2-oxidanylpropoxy)phenyl]ethanone

Systemtic Name: 3-tert-butyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 1-[2-oxidanyl-6-(2-oxidanylpropoxy)phenyl]ethanone Openeye Name: 3-tert-butyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 1-[2-hydroxy-6-(2-hydroxypropoxy)phenyl]ethanone CAS Name: 3-tert-butyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 1-[2-hydroxy-6-(2-hydroxypropoxy)phenyl]ethanone IUPAC Name: 3-tert-butyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 1-[2-hydroxy-6-(2-hydroxypropoxy)phenyl]ethanone Traditional Name: 3-tert-butyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 1-[2-hydroxy-6-(2-hydroxypropoxy)phenyl]ethanone Formula: C21H26O5 MolecularWeight: 358.42814

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC(=C1C(=O)C)O)O.CC(C)(C)C1=C2C=CC(=C1)O2

Isomeric SMILES

CC(COC1=CC=CC(=C1C(=O)C)O)O.CC(C)(C)C1=C2C=CC(=C1)O2

InChI

InChI=1S/C11H14O4.C10H12O/c1-7(12)6-15-10-5-3-4-9(14)11(10)8(2)13;1-10(2,3)8-6-7-4-5-9(8)11-7/h3-5,7,12,14H,6H2,1-2H3;4-6H,1-3H3