(4S,5R)-5-(2-chloranyl-6-fluoranyl-phenyl)-2,4-dimethyl-cyclohex-2-en-1-one

Systemtic Name: (4S,5R)-5-(2-chloranyl-6-fluoranyl-phenyl)-2,4-dimethyl-cyclohex-2-en-1-one Openeye Name: (4S,5R)-5-(2-chloro-6-fluoro-phenyl)-2,4-dimethyl-cyclohex-2-en-1-one CAS Name: (4S,5R)-5-(2-chloro-6-fluorophenyl)-2,4-dimethyl-1-cyclohex-2-enone IUPAC Name: (4S,5R)-5-(2-chloro-6-fluorophenyl)-2,4-dimethylcyclohex-2-en-1-one Traditional Name: (4S,5R)-5-(2-chloro-6-fluoro-phenyl)-2,4-dimethyl-cyclohex-2-en-1-one Formula: C14H14ClFO MolecularWeight: 252.711763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C(=O)CC1C2=C(C=CC=C2Cl)F)C

Isomeric SMILES

C[C@H]1C=C(C(=O)C[C@H]1C2=C(C=CC=C2Cl)F)C

InChI

InChI=1S/C14H14ClFO/c1-8-6-9(2)13(17)7-10(8)14-11(15)4-3-5-12(14)16/h3-6,8,10H,7H2,1-2H3/t8-,10+/m0/s1