1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-[2,3,4-tris(fluoranyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-[2,3,4-tris(fluoranyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-(2,3,4-trifluorophenyl)piperidine-4-carboxamide CAS Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-(2,3,4-trifluorophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-(2,3,4-trifluorophenyl)piperidine-4-carboxamide Traditional Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-(2,3,4-trifluorophenyl)isonipecotamide Formula: C18H15ClF3N3O5S MolecularWeight: 477.84201

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C(=C(C=C2)F)F)F)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C(=C(C=C2)F)F)F)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H15ClF3N3O5S/c19-12-2-1-11(25(27)28)9-15(12)31(29,30)24-7-5-10(6-8-24)18(26)23-14-4-3-13(20)16(21)17(14)22/h1-4,9-10H,5-8H2,(H,23,26)