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

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-2-(4-nitropyrazol-1-yl)butyramide Formula: C17H16ClFN6O3 MolecularWeight: 406.798743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN(C=C1)CC2=C(C=CC=C2Cl)F)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=NN(C=C1)CC2=C(C=CC=C2Cl)F)N3C=C(C=N3)[N+](=O)[O-]

InChI

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