1-(2-fluoranyl-5-methylsulfonyl-phenyl)sulfonyl-2-methyl-piperidine

Systemtic Name: 1-(2-fluoranyl-5-methylsulfonyl-phenyl)sulfonyl-2-methyl-piperidine Openeye Name: 1-(2-fluoro-5-methylsulfonyl-phenyl)sulfonyl-2-methyl-piperidine CAS Name: 1-(2-fluoro-5-methylsulfonylphenyl)sulfonyl-2-methylpiperidine IUPAC Name: 1-(2-fluoro-5-methylsulfonylphenyl)sulfonyl-2-methylpiperidine Traditional Name: 1-(2-fluoro-5-mesyl-phenyl)sulfonyl-2-methyl-piperidine Formula: C13H18FNO4S2 MolecularWeight: 335.414723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)S(=O)(=O)C)F

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)S(=O)(=O)C)F

InChI

InChI=1S/C13H18FNO4S2/c1-10-5-3-4-8-15(10)21(18,19)13-9-11(20(2,16)17)6-7-12(13)14/h6-7,9-10H,3-5,8H2,1-2H3