[2,4-bis(oxidanylidene)-3-propyl-3-bicyclo[3.2.2]nona-1(7),5,8-trienyl] 3-oxidanylidenebutanoate

Systemtic Name: [2,4-bis(oxidanylidene)-3-propyl-3-bicyclo[3.2.2]nona-1(7),5,8-trienyl] 3-oxidanylidenebutanoate Openeye Name: (2,4-dioxo-3-propyl-3-bicyclo[3.2.2]nona-1(7),5,8-trienyl) 3-oxobutanoate CAS Name: 3-oxobutanoic acid (2,4-dioxo-3-propyl-3-bicyclo[3.2.2]nona-1(7),5,8-trienyl) ester IUPAC Name: (2,4-dioxo-3-propyl-3-bicyclo[3.2.2]nona-1(7),5,8-trienyl) 3-oxobutanoate Traditional Name: 3-ketobutyric acid (2,4-diketo-3-propyl-3-bicyclo[3.2.2]nona-1(7),5,8-trienyl) ester Formula: C16H16O5 MolecularWeight: 288.29524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)C2=CC=C(C1=O)C=C2)OC(=O)CC(=O)C

Isomeric SMILES

CCCC1(C(=O)C2=CC=C(C1=O)C=C2)OC(=O)CC(=O)C

InChI

InChI=1S/C16H16O5/c1-3-8-16(21-13(18)9-10(2)17)14(19)11-4-5-12(7-6-11)15(16)20/h4-7H,3,8-9H2,1-2H3