hexane; 4-(2-oxidanylidenepropyl)-4-pentyl-heptane-2,6-dione

Systemtic Name: hexane; 4-(2-oxidanylidenepropyl)-4-pentyl-heptane-2,6-dione Openeye Name: 4-acetonyl-4-pentyl-heptane-2,6-dione; hexane CAS Name: hexane; 4-(2-oxopropyl)-4-pentylheptane-2,6-dione IUPAC Name: hexane; 4-(2-oxopropyl)-4-pentylheptane-2,6-dione Traditional Name: 4-acetonyl-4-amyl-heptane-2,6-dione; n-hexane Formula: C51H110O3 MolecularWeight: 771.4173

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC.CCCCCC.CCCCCC.CCCCCC.CCCCCC.CCCCCC.CCCCCC(CC(=O)C)(CC(=O)C)CC(=O)C

Isomeric SMILES

CCCCCC.CCCCCC.CCCCCC.CCCCCC.CCCCCC.CCCCCC.CCCCCC(CC(=O)C)(CC(=O)C)CC(=O)C

InChI

InChI=1S/C15H26O3.6C6H14/c1-5-6-7-8-15(9-12(2)16,10-13(3)17)11-14(4)18;6*1-3-5-6-4-2/h5-11H2,1-4H3;6*3-6H2,1-2H3