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

Systemtic Name: N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-(2-bromo-4,6-difluoro-phenyl)-4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-(2-bromo-4,6-difluorophenyl)-4-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(2-bromo-4,6-difluorophenyl)-4-(4-chloro-5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-(2-bromo-4,6-difluoro-phenyl)-4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C14H12BrClF2N4O3 MolecularWeight: 437.623886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12BrClF2N4O3/c1-7-12(16)14(22(24)25)20-21(7)4-2-3-11(23)19-13-9(15)5-8(17)6-10(13)18/h5-6H,2-4H2,1H3,(H,19,23)