2-(4-fluorophenyl)-N5-(2-methyl-3-nitro-phenyl)-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: 2-(4-fluorophenyl)-N5-(2-methyl-3-nitro-phenyl)-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: 2-(4-fluorophenyl)-N5-(2-methyl-3-nitro-phenyl)-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: 2-(4-fluorophenyl)-N5-(2-methyl-3-nitrophenyl)-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 2-(4-fluorophenyl)-5-N-(2-methyl-3-nitrophenyl)-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: 1-(4-fluorophenyl)-N-(2-methyl-3-nitro-phenyl)-2-pyrazoline-3,5-dicarboxamide Formula: C18H16FN5O4 MolecularWeight: 385.349143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=NN(C(C2)C(=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=NN(C(C2)C(=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FN5O4/c1-10-13(3-2-4-15(10)24(27)28)21-18(26)14-9-16(17(20)25)23(22-14)12-7-5-11(19)6-8-12/h2-8,16H,9H2,1H3,(H2,20,25)(H,21,26)