(4-nitro-3-oxidanyl-phenyl)-[3-(trifluoromethyl)piperidin-1-yl]methanone

Systemtic Name: (4-nitro-3-oxidanyl-phenyl)-[3-(trifluoromethyl)piperidin-1-yl]methanone Openeye Name: (3-hydroxy-4-nitro-phenyl)-[3-(trifluoromethyl)-1-piperidyl]methanone CAS Name: (3-hydroxy-4-nitrophenyl)-[3-(trifluoromethyl)-1-piperidinyl]methanone IUPAC Name: (3-hydroxy-4-nitrophenyl)-[3-(trifluoromethyl)piperidin-1-yl]methanone Traditional Name: (3-hydroxy-4-nitro-phenyl)-[3-(trifluoromethyl)piperidino]methanone Formula: C13H13F3N2O4 MolecularWeight: 318.24853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13F3N2O4/c14-13(15,16)9-2-1-5-17(7-9)12(20)8-3-4-10(18(21)22)11(19)6-8/h3-4,6,9,19H,1-2,5,7H2