methyl 6,6-bis(3-fluorophenyl)-1,7-dihydroindazole-3-carboxylate

Systemtic Name: methyl 6,6-bis(3-fluorophenyl)-1,7-dihydroindazole-3-carboxylate Openeye Name: methyl 6,6-bis(3-fluorophenyl)-1,7-dihydroindazole-3-carboxylate CAS Name: 6,6-bis(3-fluorophenyl)-1,7-dihydroindazole-3-carboxylic acid methyl ester IUPAC Name: methyl 6,6-bis(3-fluorophenyl)-1,7-dihydroindazole-3-carboxylate Traditional Name: 6,6-bis(3-fluorophenyl)-1,7-dihydroindazole-3-carboxylic acid methyl ester Formula: C21H16F2N2O2 MolecularWeight: 366.360746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NNC2=C1C=CC(C2)(C3=CC(=CC=C3)F)C4=CC(=CC=C4)F

Isomeric SMILES

COC(=O)C1=NNC2=C1C=CC(C2)(C3=CC(=CC=C3)F)C4=CC(=CC=C4)F

InChI

InChI=1S/C21H16F2N2O2/c1-27-20(26)19-17-8-9-21(12-18(17)24-25-19,13-4-2-6-15(22)10-13)14-5-3-7-16(23)11-14/h2-11H,12H2,1H3,(H,24,25)