N-[(4-fluorophenyl)methyl]-5-(5-methylfuran-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-5-(5-methylfuran-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-5-(5-methyl-2-furyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-5-(5-methyl-2-furanyl)-2-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-5-(5-methylfuran-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-(4-fluorobenzyl)-5-(5-methyl-2-furyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C22H17FN4O4 MolecularWeight: 420.393183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NN(C(=C2)C(=O)NCC3=CC=C(C=C3)F)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)C2=NN(C(=C2)C(=O)NCC3=CC=C(C=C3)F)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17FN4O4/c1-14-5-10-21(31-14)19-12-20(22(28)24-13-15-6-8-16(23)9-7-15)26(25-19)17-3-2-4-18(11-17)27(29)30/h2-12H,13H2,1H3,(H,24,28)