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

Systemtic Name: (4S,5R)-5-(2-chloranyl-6-fluoranyl-phenyl)-4-methyl-cyclohex-2-en-1-one Openeye Name: (4S,5R)-5-(2-chloro-6-fluoro-phenyl)-4-methyl-cyclohex-2-en-1-one CAS Name: (4S,5R)-5-(2-chloro-6-fluorophenyl)-4-methyl-1-cyclohex-2-enone IUPAC Name: (4S,5R)-5-(2-chloro-6-fluorophenyl)-4-methylcyclohex-2-en-1-one Traditional Name: (4S,5R)-5-(2-chloro-6-fluoro-phenyl)-4-methyl-cyclohex-2-en-1-one Formula: C13H12ClFO MolecularWeight: 238.685183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12ClFO/c1-8-5-6-9(16)7-10(8)13-11(14)3-2-4-12(13)15/h2-6,8,10H,7H2,1H3/t8-,10+/m0/s1