1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid Openeye Name: 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid CAS Name: 1-(4-nitrophenyl)-5-(trifluoromethyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid Traditional Name: 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid Formula: C11H6F3N3O4 MolecularWeight: 301.17825

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=C(C=N2)C(=O)O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N2C(=C(C=N2)C(=O)O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H6F3N3O4/c12-11(13,14)9-8(10(18)19)5-15-16(9)6-1-3-7(4-2-6)17(20)21/h1-5H,(H,18,19)