2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide CAS Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propionamide Formula: C22H22F6N4O6 MolecularWeight: 552.423699

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C11H11F3N2O3/c2*1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14/h2*3-6H,1-2H3,(H,15,17)