N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide Openeye Name: N-(2-bromo-4,6-difluoro-phenyl)-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide CAS Name: N-(2-bromo-4,6-difluorophenyl)-4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(2-bromo-4,6-difluorophenyl)-4-(3,5-dimethyl-4-nitropyrazol-1-yl)butanamide Traditional Name: N-(2-bromo-4,6-difluoro-phenyl)-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butyramide Formula: C15H15BrF2N4O3 MolecularWeight: 417.205406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NC2=C(C=C(C=C2Br)F)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NC2=C(C=C(C=C2Br)F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C15H15BrF2N4O3/c1-8-15(22(24)25)9(2)21(20-8)5-3-4-13(23)19-14-11(16)6-10(17)7-12(14)18/h6-7H,3-5H2,1-2H3,(H,19,23)