4-[4-[(3-fluorophenyl)methylidene]piperidin-1-yl]sulfonyl-N,N-dimethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[4-[(3-fluorophenyl)methylidene]piperidin-1-yl]sulfonyl-N,N-dimethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[[4-[(3-fluorophenyl)methylene]-1-piperidyl]sulfonyl]-N,N-dimethyl-3-nitro-benzenesulfonamide CAS Name: 4-[[4-[(3-fluorophenyl)methylidene]-1-piperidinyl]sulfonyl]-N,N-dimethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[4-[(3-fluorophenyl)methylidene]piperidin-1-yl]sulfonyl-N,N-dimethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[4-(3-fluorobenzylidene)piperidino]sulfonyl-N,N-dimethyl-3-nitro-benzenesulfonamide Formula: C20H22FN3O6S2 MolecularWeight: 483.533583

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)N2CCC(=CC3=CC(=CC=C3)F)CC2)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)N2CCC(=CC3=CC(=CC=C3)F)CC2)[N+](=O)[O-]

InChI

InChI=1S/C20H22FN3O6S2/c1-22(2)31(27,28)18-6-7-20(19(14-18)24(25)26)32(29,30)23-10-8-15(9-11-23)12-16-4-3-5-17(21)13-16/h3-7,12-14H,8-11H2,1-2H3