methyl 4-methyl-2-oxidanylidene-3-pentyl-cyclopent-3-ene-1-carboxylate

Systemtic Name: methyl 4-methyl-2-oxidanylidene-3-pentyl-cyclopent-3-ene-1-carboxylate Openeye Name: methyl 4-methyl-2-oxo-3-pentyl-cyclopent-3-ene-1-carboxylate CAS Name: 4-methyl-2-oxo-3-pentyl-1-cyclopent-3-enecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-oxo-3-pentylcyclopent-3-ene-1-carboxylate Traditional Name: 3-amyl-2-keto-4-methyl-cyclopent-3-ene-1-carboxylic acid methyl ester Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(CC(C1=O)C(=O)OC)C

Isomeric SMILES

CCCCCC1=C(CC(C1=O)C(=O)OC)C

InChI

InChI=1S/C13H20O3/c1-4-5-6-7-10-9(2)8-11(12(10)14)13(15)16-3/h11H,4-8H2,1-3H3