[(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 4-chloranyl-3-sulfamoyl-benzoate

Systemtic Name: [(2S)-6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 4-chloranyl-3-sulfamoyl-benzoate Openeye Name: [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl 4-chloro-3-sulfamoyl-benzoate CAS Name: 4-chloro-3-sulfamoylbenzoic 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 4-chloro-3-sulfamoylbenzoate Traditional Name: 4-chloro-3-sulfamoyl-benzoic acid [(2S)-6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl ester Formula: C22H17ClFNO6S MolecularWeight: 477.889883

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)COC(=O)C4=CC(=C(C=C4)Cl)S(=O)(=O)N)F

Isomeric SMILES

C1C2=CC(=CC(=C2O[C@H](O1)C3=CC=CC=C3)COC(=O)C4=CC(=C(C=C4)Cl)S(=O)(=O)N)F

InChI

InChI=1S/C22H17ClFNO6S/c23-18-7-6-14(10-19(18)32(25,27)28)21(26)29-11-15-8-17(24)9-16-12-30-22(31-20(15)16)13-4-2-1-3-5-13/h1-10,22H,11-12H2,(H2,25,27,28)/t22-/m0/s1