1-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-(2-nitro-4-triflyl-phenyl)-N-phenyl-nipecotamide Formula: C19H18F3N3O5S MolecularWeight: 457.42353

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

InChI

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