N-[4-bromanyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-2-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-2-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[4-bromo-1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-2-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-2-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-2-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[4-bromo-1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-2-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C16H13BrClFN6O3 MolecularWeight: 471.668223

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=NN(C=C2Br)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=NN(C=C2Br)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H13BrClFN6O3/c1-2-24-14(13(6-20-24)25(27)28)16(26)21-15-10(17)8-23(22-15)7-9-11(18)4-3-5-12(9)19/h3-6,8H,2,7H2,1H3,(H,21,22,26)