(4S)-5-methyl-4-oxidanyl-2-(2-oxidanylpropan-2-yl)cyclohex-2-en-1-one

Systemtic Name: (4S)-5-methyl-4-oxidanyl-2-(2-oxidanylpropan-2-yl)cyclohex-2-en-1-one Openeye Name: (4S)-4-hydroxy-2-(1-hydroxy-1-methyl-ethyl)-5-methyl-cyclohex-2-en-1-one CAS Name: (4S)-4-hydroxy-2-(2-hydroxypropan-2-yl)-5-methyl-1-cyclohex-2-enone IUPAC Name: (4S)-4-hydroxy-2-(2-hydroxypropan-2-yl)-5-methylcyclohex-2-en-1-one Traditional Name: (4S)-4-hydroxy-2-(1-hydroxy-1-methyl-ethyl)-5-methyl-cyclohex-2-en-1-one Formula: C10H16O3 MolecularWeight: 184.23224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(=CC1O)C(C)(C)O

Isomeric SMILES

CC1CC(=O)C(=C[C@H]1O)C(C)(C)O

InChI

InChI=1S/C10H16O3/c1-6-4-9(12)7(5-8(6)11)10(2,3)13/h5-6,8,11,13H,4H2,1-3H3/t6?,8-/m1/s1