1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]pyrazole-4-carboxylic acid Openeye Name: 1-[(4-bromo-2-fluoro-phenyl)methyl]pyrazole-4-carboxylic acid CAS Name: 1-[(4-bromo-2-fluorophenyl)methyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[(4-bromo-2-fluorophenyl)methyl]pyrazole-4-carboxylic acid Traditional Name: 1-(4-bromo-2-fluoro-benzyl)pyrazole-4-carboxylic acid Formula: C11H8BrFN2O2 MolecularWeight: 299.095823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)CN2C=C(C=N2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)F)CN2C=C(C=N2)C(=O)O

InChI

InChI=1S/C11H8BrFN2O2/c12-9-2-1-7(10(13)3-9)5-15-6-8(4-14-15)11(16)17/h1-4,6H,5H2,(H,16,17)