N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-2-nitro-phenyl]-4-fluoranyl-3-methyl-benzenesulfonamide

Systemtic Name: N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-2-nitro-phenyl]-4-fluoranyl-3-methyl-benzenesulfonamide Openeye Name: N-[4-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]-2-nitro-phenyl]-4-fluoro-3-methyl-benzenesulfonamide CAS Name: N-[4-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]-2-nitrophenyl]-4-fluoro-3-methylbenzenesulfonamide IUPAC Name: N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-2-nitrophenyl]-4-fluoro-3-methylbenzenesulfonamide Traditional Name: N-[4-[(3R,5R)-3,5-dimethylpiperidino]sulfonyl-2-nitro-phenyl]-4-fluoro-3-methyl-benzenesulfonamide Formula: C20H24FN3O6S2 MolecularWeight: 485.549463

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)C)[N+](=O)[O-])C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)S(=O)(=O)C2=CC(=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)C)[N+](=O)[O-])C

InChI

InChI=1S/C20H24FN3O6S2/c1-13-8-14(2)12-23(11-13)32(29,30)17-5-7-19(20(10-17)24(25)26)22-31(27,28)16-4-6-18(21)15(3)9-16/h4-7,9-10,13-14,22H,8,11-12H2,1-3H3/t13-,14-/m1/s1