ethanoic acid; 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]-2-oxidanyl-propanamide

Systemtic Name: ethanoic acid; 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]-2-oxidanyl-propanamide Openeye Name: acetic acid; 2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide CAS Name: acetic acid; 2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide IUPAC Name: acetic acid; 2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide Traditional Name: acetic acid; 2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propionamide Formula: C13H15F3N2O6 MolecularWeight: 352.26321

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CC(C)(C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F)O

Isomeric SMILES

CC(=O)O.CC(C)(C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F)O

InChI

InChI=1S/C11H11F3N2O4.C2H4O2/c1-10(2,18)9(17)15-6-3-4-8(16(19)20)7(5-6)11(12,13)14;1-2(3)4/h3-5,18H,1-2H3,(H,15,17);1H3,(H,3,4)