(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-chloranyl-3-(oxolan-2-ylmethylsulfamoyl)benzoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-chloranyl-3-(oxolan-2-ylmethylsulfamoyl)benzoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-chloro-3-(tetrahydrofuran-2-ylmethylsulfamoyl)benzoate CAS Name: 4-chloro-3-(2-oxolanylmethylsulfamoyl)benzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-chloro-3-(oxolan-2-ylmethylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(tetrahydrofurfurylsulfamoyl)benzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C21H20ClN3O6S MolecularWeight: 477.918

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=NC(=NO3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CC(OC1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=NC(=NO3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H20ClN3O6S/c22-17-9-8-15(11-18(17)32(27,28)23-12-16-7-4-10-29-16)21(26)30-13-19-24-20(25-31-19)14-5-2-1-3-6-14/h1-3,5-6,8-9,11,16,23H,4,7,10,12-13H2