N-[[1-(4-chloranyl-2-methylsulfonyl-phenyl)sulfonylpiperidin-4-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-(4-chloranyl-2-methylsulfonyl-phenyl)sulfonylpiperidin-4-yl]methyl]methanesulfonamide Openeye Name: N-[[1-(4-chloro-2-methylsulfonyl-phenyl)sulfonyl-4-piperidyl]methyl]methanesulfonamide CAS Name: N-[[1-(4-chloro-2-methylsulfonylphenyl)sulfonyl-4-piperidinyl]methyl]methanesulfonamide IUPAC Name: N-[[1-(4-chloro-2-methylsulfonylphenyl)sulfonylpiperidin-4-yl]methyl]methanesulfonamide Traditional Name: N-[[1-(4-chloro-2-mesyl-phenyl)sulfonyl-4-piperidyl]methyl]methanesulfonamide Formula: C14H21ClN2O6S3 MolecularWeight: 444.97434

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)Cl)S(=O)(=O)N2CCC(CC2)CNS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)Cl)S(=O)(=O)N2CCC(CC2)CNS(=O)(=O)C

InChI

InChI=1S/C14H21ClN2O6S3/c1-24(18,19)14-9-12(15)3-4-13(14)26(22,23)17-7-5-11(6-8-17)10-16-25(2,20)21/h3-4,9,11,16H,5-8,10H2,1-2H3