1-(4-bromanyl-2-fluoranyl-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate

Systemtic Name: 1-(4-bromanyl-2-fluoranyl-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Openeye Name: 1-(4-bromo-2-fluoro-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate CAS Name: 1-(4-bromo-2-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate IUPAC Name: 1-(4-bromo-2-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Traditional Name: 1-(4-bromo-2-fluoro-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Formula: C14H11BrFN2O2- MolecularWeight: 338.151743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NN2C3=C(C=C(C=C3)Br)F)C(=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C(=NN2C3=C(C=C(C=C3)Br)F)C(=O)[O-]

InChI

InChI=1S/C14H12BrFN2O2/c15-8-5-6-12(10(16)7-8)18-11-4-2-1-3-9(11)13(17-18)14(19)20/h5-7H,1-4H2,(H,19,20)/p-1