[2-chloranyl-5-(3,5-dimethylpyrazol-1-yl)-4-fluoranyl-phenyl] methanesulfonate

Systemtic Name: [2-chloranyl-5-(3,5-dimethylpyrazol-1-yl)-4-fluoranyl-phenyl] methanesulfonate Openeye Name: [2-chloro-5-(3,5-dimethylpyrazol-1-yl)-4-fluoro-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-chloro-5-(3,5-dimethyl-1-pyrazolyl)-4-fluorophenyl] ester IUPAC Name: [2-chloro-5-(3,5-dimethylpyrazol-1-yl)-4-fluorophenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-chloro-5-(3,5-dimethylpyrazol-1-yl)-4-fluoro-phenyl] ester Formula: C12H12ClFN2O3S MolecularWeight: 318.751683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC(=C(C=C2F)Cl)OS(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=NN1C2=CC(=C(C=C2F)Cl)OS(=O)(=O)C)C

InChI

InChI=1S/C12H12ClFN2O3S/c1-7-4-8(2)16(15-7)11-6-12(19-20(3,17)18)9(13)5-10(11)14/h4-6H,1-3H3