1-(2-fluoranyl-5-methylsulfonyl-phenyl)sulfonyl-3-methyl-piperidine

Systemtic Name: 1-(2-fluoranyl-5-methylsulfonyl-phenyl)sulfonyl-3-methyl-piperidine Openeye Name: 1-(2-fluoro-5-methylsulfonyl-phenyl)sulfonyl-3-methyl-piperidine CAS Name: 1-(2-fluoro-5-methylsulfonylphenyl)sulfonyl-3-methylpiperidine IUPAC Name: 1-(2-fluoro-5-methylsulfonylphenyl)sulfonyl-3-methylpiperidine Traditional Name: 1-(2-fluoro-5-mesyl-phenyl)sulfonyl-3-methyl-piperidine Formula: C13H18FNO4S2 MolecularWeight: 335.414723

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)S(=O)(=O)C)F

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)S(=O)(=O)C)F

InChI

InChI=1S/C13H18FNO4S2/c1-10-4-3-7-15(9-10)21(18,19)13-8-11(20(2,16)17)5-6-12(13)14/h5-6,8,10H,3-4,7,9H2,1-2H3