N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-2-(5-methyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-2-(5-methyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-4-yl]-2-(5-methyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-4-pyrazolyl]-2-(5-methyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-2-(5-methyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-4-yl]-2-(5-methyl-4-nitro-pyrazol-1-yl)propionamide Formula: C17H16ClFN6O3 MolecularWeight: 406.798743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C(C)C(=O)NC2=CN(N=C2)CC3=C(C=C(C=C3)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C(C)C(=O)NC2=CN(N=C2)CC3=C(C=C(C=C3)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClFN6O3/c1-10-16(25(27)28)7-21-24(10)11(2)17(26)22-14-6-20-23(9-14)8-12-3-4-13(19)5-15(12)18/h3-7,9,11H,8H2,1-2H3,(H,22,26)