N-(3-chloranyl-4-fluoranyl-phenyl)-4-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-(4-nitropyrazol-1-yl)butanamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-(4-nitropyrazol-1-yl)butyramide Formula: C13H12ClFN4O3 MolecularWeight: 326.710783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCCN2C=C(C=N2)[N+](=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCCN2C=C(C=N2)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C13H12ClFN4O3/c14-11-6-9(3-4-12(11)15)17-13(20)2-1-5-18-8-10(7-16-18)19(21)22/h3-4,6-8H,1-2,5H2,(H,17,20)