N-[4-bromanyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-[4-bromanyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)ethanamide Openeye Name: N-[4-bromo-1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)acetamide CAS Name: N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-2-(4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)acetamide Traditional Name: N-[4-bromo-1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)acetamide Formula: C15H11BrClFN6O3 MolecularWeight: 457.641643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CN2C=C(C(=N2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-])Br)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CN2C=C(C(=N2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-])Br)F

InChI

InChI=1S/C15H11BrClFN6O3/c16-11-7-23(6-10-12(17)2-1-3-13(10)18)21-15(11)20-14(25)8-22-5-9(4-19-22)24(26)27/h1-5,7H,6,8H2,(H,20,21,25)