3-nitro-N-[4-[3-(trifluoromethyl)piperidin-1-yl]carbonylphenyl]benzenesulfonamide

Systemtic Name: 3-nitro-N-[4-[3-(trifluoromethyl)piperidin-1-yl]carbonylphenyl]benzenesulfonamide Openeye Name: 3-nitro-N-[4-[3-(trifluoromethyl)piperidine-1-carbonyl]phenyl]benzenesulfonamide CAS Name: 3-nitro-N-[4-[oxo-[3-(trifluoromethyl)-1-piperidinyl]methyl]phenyl]benzenesulfonamide IUPAC Name: 3-nitro-N-[4-[3-(trifluoromethyl)piperidine-1-carbonyl]phenyl]benzenesulfonamide Traditional Name: 3-nitro-N-[4-[3-(trifluoromethyl)piperidine-1-carbonyl]phenyl]benzenesulfonamide Formula: C19H18F3N3O5S MolecularWeight: 457.42353

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C19H18F3N3O5S/c20-19(21,22)14-3-2-10-24(12-14)18(26)13-6-8-15(9-7-13)23-31(29,30)17-5-1-4-16(11-17)25(27)28/h1,4-9,11,14,23H,2-3,10,12H2