5-[[3,5-bis[bis(fluoranyl)methyl]-4-bromanyl-pyrazol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: 5-[[3,5-bis[bis(fluoranyl)methyl]-4-bromanyl-pyrazol-1-yl]methyl]furan-2-carboxylate Openeye Name: 5-[[4-bromo-3,5-bis(difluoromethyl)pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[4-bromo-3,5-bis(difluoromethyl)-1-pyrazolyl]methyl]-2-furancarboxylate IUPAC Name: 5-[[4-bromo-3,5-bis(difluoromethyl)pyrazol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-bromo-3,5-bis(difluoromethyl)pyrazol-1-yl]methyl]-2-furoate Formula: C11H6BrF4N2O3- MolecularWeight: 370.074553

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)C(=O)[O-])CN2C(=C(C(=N2)C(F)F)Br)C(F)F

Isomeric SMILES

C1=C(OC(=C1)C(=O)[O-])CN2C(=C(C(=N2)C(F)F)Br)C(F)F

InChI

InChI=1S/C11H7BrF4N2O3/c12-6-7(9(13)14)17-18(8(6)10(15)16)3-4-1-2-5(21-4)11(19)20/h1-2,9-10H,3H2,(H,19,20)/p-1