2-butanoyl-5-(4-methyloxan-3-yl)cyclohexane-1,3-dione

Systemtic Name: 2-butanoyl-5-(4-methyloxan-3-yl)cyclohexane-1,3-dione Openeye Name: 2-butanoyl-5-(4-methyltetrahydropyran-3-yl)cyclohexane-1,3-dione CAS Name: 5-(4-methyl-3-oxanyl)-2-(1-oxobutyl)cyclohexane-1,3-dione IUPAC Name: 2-butanoyl-5-(4-methyloxan-3-yl)cyclohexane-1,3-dione Traditional Name: 2-butyryl-5-(4-methyltetrahydropyran-3-yl)cyclohexane-1,3-quinone Formula: C16H24O4 MolecularWeight: 280.35936

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=O)CC(CC1=O)C2COCCC2C

Isomeric SMILES

CCCC(=O)C1C(=O)CC(CC1=O)C2COCCC2C

InChI

InChI=1S/C16H24O4/c1-3-4-13(17)16-14(18)7-11(8-15(16)19)12-9-20-6-5-10(12)2/h10-12,16H,3-9H2,1-2H3