3-butyl-3,6,6,9,9-pentamethyl-cyclononane-1,2,4,5-tetrone

Systemtic Name: 3-butyl-3,6,6,9,9-pentamethyl-cyclononane-1,2,4,5-tetrone Openeye Name: 3-butyl-3,6,6,9,9-pentamethyl-cyclononane-1,2,4,5-tetrone CAS Name: 3-butyl-3,6,6,9,9-pentamethylcyclononane-1,2,4,5-tetrone IUPAC Name: 3-butyl-3,6,6,9,9-pentamethylcyclononane-1,2,4,5-tetrone Traditional Name: 3-butyl-3,6,6,9,9-pentamethyl-cyclononane-1,2,4,5-diquinone Formula: C18H28O4 MolecularWeight: 308.41252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)C(=O)C(CCC(C(=O)C1=O)(C)C)(C)C)C

Isomeric SMILES

CCCCC1(C(=O)C(=O)C(CCC(C(=O)C1=O)(C)C)(C)C)C

InChI

InChI=1S/C18H28O4/c1-7-8-9-18(6)14(21)12(19)16(2,3)10-11-17(4,5)13(20)15(18)22/h7-11H2,1-6H3