(2,3,6-trimethylphenyl) 4-chloranyl-3-(diethylsulfamoyl)benzoate

Systemtic Name: (2,3,6-trimethylphenyl) 4-chloranyl-3-(diethylsulfamoyl)benzoate Openeye Name: (2,3,6-trimethylphenyl) 4-chloro-3-(diethylsulfamoyl)benzoate CAS Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 4-chloro-3-(diethylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid (2,3,6-trimethylphenyl) ester Formula: C20H24ClNO4S MolecularWeight: 409.92686

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OC2=C(C=CC(=C2C)C)C)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OC2=C(C=CC(=C2C)C)C)Cl

InChI

InChI=1S/C20H24ClNO4S/c1-6-22(7-2)27(24,25)18-12-16(10-11-17(18)21)20(23)26-19-14(4)9-8-13(3)15(19)5/h8-12H,6-7H2,1-5H3