5,6-bis(hydroxymethyl)-2,2,4-trimethyl-bicyclo[2.2.2]oct-5-en-3-one

Systemtic Name: 5,6-bis(hydroxymethyl)-2,2,4-trimethyl-bicyclo[2.2.2]oct-5-en-3-one Openeye Name: 5,6-bis(hydroxymethyl)-2,2,4-trimethyl-bicyclo[2.2.2]oct-5-en-3-one CAS Name: 5,6-bis(hydroxymethyl)-2,2,4-trimethyl-3-bicyclo[2.2.2]oct-5-enone IUPAC Name: 5,6-bis(hydroxymethyl)-2,2,4-trimethylbicyclo[2.2.2]oct-5-en-3-one Traditional Name: 2,2,4-trimethyl-5,6-dimethylol-bicyclo[2.2.2]oct-5-en-3-one Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC(C1=O)(C(=C2CO)CO)C)C

Isomeric SMILES

CC1(C2CCC(C1=O)(C(=C2CO)CO)C)C

InChI

InChI=1S/C13H20O3/c1-12(2)9-4-5-13(3,11(12)16)10(7-15)8(9)6-14/h9,14-15H,4-7H2,1-3H3