5-methoxy-2,6,6-trimethyl-4-oxidanyl-cyclohept-2-en-1-one

Systemtic Name: 5-methoxy-2,6,6-trimethyl-4-oxidanyl-cyclohept-2-en-1-one Openeye Name: 4-hydroxy-5-methoxy-2,6,6-trimethyl-cyclohept-2-en-1-one CAS Name: 4-hydroxy-5-methoxy-2,6,6-trimethyl-1-cyclohept-2-enone IUPAC Name: 4-hydroxy-5-methoxy-2,6,6-trimethylcyclohept-2-en-1-one Traditional Name: 4-hydroxy-5-methoxy-2,6,6-trimethyl-cyclohept-2-en-1-one Formula: C11H18O3 MolecularWeight: 198.25882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(C(CC1=O)(C)C)OC)O

Isomeric SMILES

CC1=CC(C(C(CC1=O)(C)C)OC)O

InChI

InChI=1S/C11H18O3/c1-7-5-8(12)10(14-4)11(2,3)6-9(7)13/h5,8,10,12H,6H2,1-4H3