ethyl (1S,5R)-2-oxidanylidene-5-pentyl-cyclopent-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,5R)-2-oxidanylidene-5-pentyl-cyclopent-3-ene-1-carboxylate Openeye Name: ethyl (1S,5R)-2-oxo-5-pentyl-cyclopent-3-ene-1-carboxylate CAS Name: (1S,5R)-2-oxo-5-pentyl-1-cyclopent-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,5R)-2-oxo-5-pentylcyclopent-3-ene-1-carboxylate Traditional Name: (1S,2R)-2-amyl-5-keto-cyclopent-3-ene-1-carboxylic acid ethyl ester Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C=CC(=O)C1C(=O)OCC

Isomeric SMILES

CCCCC[C@@H]1C=CC(=O)[C@H]1C(=O)OCC

InChI

InChI=1S/C13H20O3/c1-3-5-6-7-10-8-9-11(14)12(10)13(15)16-4-2/h8-10,12H,3-7H2,1-2H3/t10-,12+/m1/s1