2-(2-oxidanylidenepropyl)-2-pentyl-cyclopentane-1,3-dione

Systemtic Name: 2-(2-oxidanylidenepropyl)-2-pentyl-cyclopentane-1,3-dione Openeye Name: 2-acetonyl-2-pentyl-cyclopentane-1,3-dione CAS Name: 2-(2-oxopropyl)-2-pentylcyclopentane-1,3-dione IUPAC Name: 2-(2-oxopropyl)-2-pentylcyclopentane-1,3-dione Traditional Name: 2-acetonyl-2-amyl-cyclopentane-1,3-quinone Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C(=O)CCC1=O)CC(=O)C

Isomeric SMILES

CCCCCC1(C(=O)CCC1=O)CC(=O)C

InChI

InChI=1S/C13H20O3/c1-3-4-5-8-13(9-10(2)14)11(15)6-7-12(13)16/h3-9H2,1-2H3