2-(2-methyl-1-oxidanyl-propyl)-3-oxidanyl-pyran-4-one

Systemtic Name: 2-(2-methyl-1-oxidanyl-propyl)-3-oxidanyl-pyran-4-one Openeye Name: 3-hydroxy-2-(1-hydroxy-2-methyl-propyl)pyran-4-one CAS Name: 3-hydroxy-2-(1-hydroxy-2-methylpropyl)-4-pyranone IUPAC Name: 3-hydroxy-2-(1-hydroxy-2-methylpropyl)pyran-4-one Traditional Name: 3-hydroxy-2-(1-hydroxy-2-methyl-propyl)pyran-4-one Formula: C9H12O4 MolecularWeight: 184.18918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C(C(=O)C=CO1)O)O

Isomeric SMILES

CC(C)C(C1=C(C(=O)C=CO1)O)O

InChI

InChI=1S/C9H12O4/c1-5(2)7(11)9-8(12)6(10)3-4-13-9/h3-5,7,11-12H,1-2H3