2-[(1S,2R,5R)-5-methyl-1-oxidanyl-2-propan-2-yl-cyclohexyl]cyclohex-2-en-1-one

Systemtic Name: 2-[(1S,2R,5R)-5-methyl-1-oxidanyl-2-propan-2-yl-cyclohexyl]cyclohex-2-en-1-one Openeye Name: 2-[(1S,2R,5R)-1-hydroxy-2-isopropyl-5-methyl-cyclohexyl]cyclohex-2-en-1-one CAS Name: 2-[(1S,2R,5R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexyl]-1-cyclohex-2-enone IUPAC Name: 2-[(1S,2R,5R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexyl]cyclohex-2-en-1-one Traditional Name: 2-[(1S,2R,5R)-1-hydroxy-2-isopropyl-5-methyl-cyclohexyl]cyclohex-2-en-1-one Formula: C16H26O2 MolecularWeight: 250.37644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)(C2=CCCCC2=O)O)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@@H]([C@@](C1)(C2=CCCCC2=O)O)C(C)C

InChI

InChI=1S/C16H26O2/c1-11(2)13-9-8-12(3)10-16(13,18)14-6-4-5-7-15(14)17/h6,11-13,18H,4-5,7-10H2,1-3H3/t12-,13-,16+/m1/s1