1-(4-fluoranyl-2-methylsulfonyl-phenyl)-3-methyl-piperazine hydrochloride

Systemtic Name: 1-(4-fluoranyl-2-methylsulfonyl-phenyl)-3-methyl-piperazine hydrochloride Openeye Name: 1-(4-fluoro-2-methylsulfonyl-phenyl)-3-methyl-piperazine hydrochloride CAS Name: 1-(4-fluoro-2-methylsulfonylphenyl)-3-methylpiperazine hydrochloride IUPAC Name: 1-(4-fluoro-2-methylsulfonylphenyl)-3-methylpiperazine hydrochloride Traditional Name: 1-(4-fluoro-2-mesyl-phenyl)-3-methyl-piperazine hydrochloride Formula: C12H18ClFN2O2S MolecularWeight: 308.799923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C(C=C(C=C2)F)S(=O)(=O)C.Cl

Isomeric SMILES

CC1CN(CCN1)C2=C(C=C(C=C2)F)S(=O)(=O)C.Cl

InChI

InChI=1S/C12H17FN2O2S.ClH/c1-9-8-15(6-5-14-9)11-4-3-10(13)7-12(11)18(2,16)17;/h3-4,7,9,14H,5-6,8H2,1-2H3;1H