3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-fluoranyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-fluoranyl-3-nitro-phenyl)propanamide Openeye Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-fluoro-3-nitro-phenyl)propanamide CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-(4-fluoro-3-nitrophenyl)propanamide IUPAC Name: 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(4-fluoro-3-nitrophenyl)propanamide Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-fluoro-3-nitro-phenyl)propionamide Formula: C20H19FN4O3 MolecularWeight: 382.388263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H19FN4O3/c1-13-17(14(2)24(23-13)16-6-4-3-5-7-16)9-11-20(26)22-15-8-10-18(21)19(12-15)25(27)28/h3-8,10,12H,9,11H2,1-2H3,(H,22,26)