(2-bromanyl-4,5-diethoxy-phenyl)methyl 2-chloranyl-5-(dimethylsulfamoyl)benzoate

Systemtic Name: (2-bromanyl-4,5-diethoxy-phenyl)methyl 2-chloranyl-5-(dimethylsulfamoyl)benzoate Openeye Name: (2-bromo-4,5-diethoxy-phenyl)methyl 2-chloro-5-(dimethylsulfamoyl)benzoate CAS Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid (2-bromo-4,5-diethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-diethoxyphenyl)methyl 2-chloro-5-(dimethylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid (2-bromo-4,5-diethoxy-benzyl) ester Formula: C20H23BrClNO6S MolecularWeight: 520.82172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)Cl)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)Cl)Br)OCC

InChI

InChI=1S/C20H23BrClNO6S/c1-5-27-18-9-13(16(21)11-19(18)28-6-2)12-29-20(24)15-10-14(7-8-17(15)22)30(25,26)23(3)4/h7-11H,5-6,12H2,1-4H3