1-(4-fluoranyl-3-nitro-phenyl)-4-(2-hydroxyethyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(4-fluoranyl-3-nitro-phenyl)-4-(2-hydroxyethyl)pyrazole-3-carboxylic acid Openeye Name: 1-(4-fluoro-3-nitro-phenyl)-4-(2-hydroxyethyl)pyrazole-3-carboxylic acid CAS Name: 1-(4-fluoro-3-nitrophenyl)-4-(2-hydroxyethyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(4-fluoro-3-nitrophenyl)-4-(2-hydroxyethyl)pyrazole-3-carboxylic acid Traditional Name: 1-(4-fluoro-3-nitro-phenyl)-4-(2-hydroxyethyl)pyrazole-3-carboxylic acid Formula: C12H10FN3O5 MolecularWeight: 295.223303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10FN3O5/c13-9-2-1-8(5-10(9)16(20)21)15-6-7(3-4-17)11(14-15)12(18)19/h1-2,5-6,17H,3-4H2,(H,18,19)