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

Systemtic Name: N-[4-bromanyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[4-bromo-1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[4-bromo-1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C16H13BrClFN6O3 MolecularWeight: 471.668223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=NN(C=C2Br)CC3=C(C=CC=C3Cl)F)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=NN(C=C2Br)CC3=C(C=CC=C3Cl)F)C

InChI

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