5-nitro-2-(phenylmethyl)-N-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 5-nitro-2-(phenylmethyl)-N-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Openeye Name: 2-benzyl-5-nitro-N-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide CAS Name: 5-nitro-2-(phenylmethyl)-N-[3-(trifluoromethyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-benzyl-5-nitro-N-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Traditional Name: 2-benzyl-5-nitro-N-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Formula: C18H13F3N4O3 MolecularWeight: 390.31603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC(=N2)[N+](=O)[O-])C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC(=N2)[N+](=O)[O-])C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H13F3N4O3/c19-18(20,21)13-7-4-8-14(9-13)22-17(26)15-10-16(25(27)28)23-24(15)11-12-5-2-1-3-6-12/h1-10H,11H2,(H,22,26)