2-(4-oxidanylidene-3-pentyl-cyclopent-2-en-1-yl)propanedioic acid

Systemtic Name: 2-(4-oxidanylidene-3-pentyl-cyclopent-2-en-1-yl)propanedioic acid Openeye Name: 2-(4-oxo-3-pentyl-cyclopent-2-en-1-yl)propanedioic acid CAS Name: 2-(4-oxo-3-pentyl-1-cyclopent-2-enyl)propanedioic acid IUPAC Name: 2-(4-oxo-3-pentylcyclopent-2-en-1-yl)propanedioic acid Traditional Name: 2-(3-amyl-4-keto-cyclopent-2-en-1-yl)malonic acid Formula: C13H18O5 MolecularWeight: 254.27902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(CC1=O)C(C(=O)O)C(=O)O

Isomeric SMILES

CCCCCC1=CC(CC1=O)C(C(=O)O)C(=O)O

InChI

InChI=1S/C13H18O5/c1-2-3-4-5-8-6-9(7-10(8)14)11(12(15)16)13(17)18/h6,9,11H,2-5,7H2,1H3,(H,15,16)(H,17,18)