butan-2-yl propanoate; 5-ethyl-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one

Systemtic Name: butan-2-yl propanoate; 5-ethyl-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Openeye Name: 5-ethyl-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one; sec-butyl propanoate CAS Name: 5-ethyl-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one; propanoic acid butan-2-yl ester IUPAC Name: butan-2-yl propanoate; 5-ethyl-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Traditional Name: 5-ethyl-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one; propionic acid sec-butyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=CC(=C1)C(=O)O2.CCC(C)OC(=O)CC

Isomeric SMILES

CCC1=C2C=CC(=C1)C(=O)O2.CCC(C)OC(=O)CC

InChI

InChI=1S/C9H8O2.C7H14O2/c1-2-6-5-7-3-4-8(6)11-9(7)10;1-4-6(3)9-7(8)5-2/h3-5H,2H2,1H3;6H,4-5H2,1-3H3