5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-pentyl-pyrazole-3-carboxamide

Systemtic Name: 5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-pentyl-pyrazole-3-carboxamide Openeye Name: 5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-pentyl-pyrazole-3-carboxamide CAS Name: 5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-pentyl-3-pyrazolecarboxamide IUPAC Name: 5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-pentylpyrazole-3-carboxamide Traditional Name: N-amyl-5-(2-fluorophenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C21H21FN4O3 MolecularWeight: 396.414843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3F

Isomeric SMILES

CCCCCNC(=O)C1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3F

InChI

InChI=1S/C21H21FN4O3/c1-2-3-6-13-23-21(27)20-14-19(17-7-4-5-8-18(17)22)24-25(20)15-9-11-16(12-10-15)26(28)29/h4-5,7-12,14H,2-3,6,13H2,1H3,(H,23,27)