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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H16ClFN6O3/c1-11(8-24-9-12(7-20-24)25(27)28)17(26)21-16-5-6-23(22-16)10-13-14(18)3-2-4-15(13)19/h2-7,9,11H,8,10H2,1H3,(H,21,22,26)