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

Systemtic Name: butan-2-yl butanoate; 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 butanoate CAS Name: butanoic acid butan-2-yl ester; 5-ethyl-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one IUPAC Name: butan-2-yl butanoate; 5-ethyl-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Traditional Name: butyric acid sec-butyl ester; 5-ethyl-3-oxabicyclo[2.2.2]octa-1(6),4,7-trien-2-one Formula: C17H24O4 MolecularWeight: 292.37006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8O2.C8H16O2/c1-2-6-5-7-3-4-8(6)11-9(7)10;1-4-6-8(9)10-7(3)5-2/h3-5H,2H2,1H3;7H,4-6H2,1-3H3