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

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-chloranyl-3-(diethylsulfamoyl)benzoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-chloro-3-(diethylsulfamoyl)benzoate CAS Name: 4-chloro-3-(diethylsulfamoyl)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-(diethylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C20H20ClN3O5S MolecularWeight: 449.9079

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C20H20ClN3O5S/c1-3-24(4-2)30(26,27)17-12-15(10-11-16(17)21)20(25)28-13-18-22-19(23-29-18)14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3