butan-2-yl 2-methanoylbicyclo[2.2.1]hept-5-ene-3-carboxylate

Systemtic Name: butan-2-yl 2-methanoylbicyclo[2.2.1]hept-5-ene-3-carboxylate Openeye Name: sec-butyl 2-formylbicyclo[2.2.1]hept-5-ene-3-carboxylate CAS Name: 2-formyl-3-bicyclo[2.2.1]hept-5-enecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-formylbicyclo[2.2.1]hept-5-ene-3-carboxylate Traditional Name: 2-formylbicyclo[2.2.1]hept-5-ene-3-carboxylic acid sec-butyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1C2CC(C1C=O)C=C2

Isomeric SMILES

CCC(C)OC(=O)C1C2CC(C1C=O)C=C2

InChI

InChI=1S/C13H18O3/c1-3-8(2)16-13(15)12-10-5-4-9(6-10)11(12)7-14/h4-5,7-12H,3,6H2,1-2H3