1-[(4-bromanyl-2-fluoranyl-phenoxy)methyl]-4-chloranyl-pyrazole-3-carboxylic acid

Systemtic Name: 1-[(4-bromanyl-2-fluoranyl-phenoxy)methyl]-4-chloranyl-pyrazole-3-carboxylic acid Openeye Name: 1-[(4-bromo-2-fluoro-phenoxy)methyl]-4-chloro-pyrazole-3-carboxylic acid CAS Name: 1-[(4-bromo-2-fluorophenoxy)methyl]-4-chloro-3-pyrazolecarboxylic acid IUPAC Name: 1-[(4-bromo-2-fluorophenoxy)methyl]-4-chloropyrazole-3-carboxylic acid Traditional Name: 1-[(4-bromo-2-fluoro-phenoxy)methyl]-4-chloro-pyrazole-3-carboxylic acid Formula: C11H7BrClFN2O3 MolecularWeight: 349.540283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)OCN2C=C(C(=N2)C(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1Br)F)OCN2C=C(C(=N2)C(=O)O)Cl

InChI

InChI=1S/C11H7BrClFN2O3/c12-6-1-2-9(8(14)3-6)19-5-16-4-7(13)10(15-16)11(17)18/h1-4H,5H2,(H,17,18)