N-(2-fluoranyl-5-nitro-phenyl)-1-(3-fluorophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name: N-(2-fluoranyl-5-nitro-phenyl)-1-(3-fluorophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide Openeye Name: N-(2-fluoro-5-nitro-phenyl)-1-(3-fluorophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: N-(2-fluoro-5-nitrophenyl)-1-(3-fluorophenyl)-5-(4-piperidinyl)-4-pyrazolecarboxamide IUPAC Name: N-(2-fluoro-5-nitrophenyl)-1-(3-fluorophenyl)-5-piperidin-4-ylpyrazole-4-carboxamide Traditional Name: N-(2-fluoro-5-nitro-phenyl)-1-(3-fluorophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide Formula: C21H19F2N5O3 MolecularWeight: 427.404066

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C(C=NN2C3=CC(=CC=C3)F)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])F

Isomeric SMILES

C1CNCCC1C2=C(C=NN2C3=CC(=CC=C3)F)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])F

InChI

InChI=1S/C21H19F2N5O3/c22-14-2-1-3-15(10-14)27-20(13-6-8-24-9-7-13)17(12-25-27)21(29)26-19-11-16(28(30)31)4-5-18(19)23/h1-5,10-13,24H,6-9H2,(H,26,29)