6-methyl-6-(5-methylfuran-2-yl)-3-oxidanyl-heptan-2-one

Systemtic Name: 6-methyl-6-(5-methylfuran-2-yl)-3-oxidanyl-heptan-2-one Openeye Name: 3-hydroxy-6-methyl-6-(5-methyl-2-furyl)heptan-2-one CAS Name: 3-hydroxy-6-methyl-6-(5-methyl-2-furanyl)-2-heptanone IUPAC Name: 3-hydroxy-6-methyl-6-(5-methylfuran-2-yl)heptan-2-one Traditional Name: 3-hydroxy-6-methyl-6-(5-methyl-2-furyl)heptan-2-one Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C)(C)CCC(C(=O)C)O

Isomeric SMILES

CC1=CC=C(O1)C(C)(C)CCC(C(=O)C)O

InChI

InChI=1S/C13H20O3/c1-9-5-6-12(16-9)13(3,4)8-7-11(15)10(2)14/h5-6,11,15H,7-8H2,1-4H3