[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 1H-indazole-3-carboxylate

Systemtic Name: [(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 1H-indazole-3-carboxylate Openeye Name: [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl ester IUPAC Name: [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl ester Formula: C23H17FN2O4 MolecularWeight: 404.390483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)COC(=O)C4=NNC5=CC=CC=C54)F

Isomeric SMILES

C1C2=CC(=CC(=C2O[C@H](O1)C3=CC=CC=C3)COC(=O)C4=NNC5=CC=CC=C54)F

InChI

InChI=1S/C23H17FN2O4/c24-17-10-15(12-28-22(27)20-18-8-4-5-9-19(18)25-26-20)21-16(11-17)13-29-23(30-21)14-6-2-1-3-7-14/h1-11,23H,12-13H2,(H,25,26)/t23-/m0/s1