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

Systemtic Name: 2-bromanyl-3-methyl-N-[2-nitro-4-(trifluoromethyl)phenyl]butanamide Openeye Name: 2-bromo-3-methyl-N-[2-nitro-4-(trifluoromethyl)phenyl]butanamide CAS Name: 2-bromo-3-methyl-N-[2-nitro-4-(trifluoromethyl)phenyl]butanamide IUPAC Name: 2-bromo-3-methyl-N-[2-nitro-4-(trifluoromethyl)phenyl]butanamide Traditional Name: 2-bromo-3-methyl-N-[2-nitro-4-(trifluoromethyl)phenyl]butyramide Formula: C12H12BrF3N2O3 MolecularWeight: 369.13449

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12BrF3N2O3/c1-6(2)10(13)11(19)17-8-4-3-7(12(14,15)16)5-9(8)18(20)21/h3-6,10H,1-2H3,(H,17,19)