(4,5-dimethoxy-2-methyl-phenyl)methyl 2-bromanyl-5-(prop-2-enylsulfamoyl)benzoate

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 2-bromanyl-5-(prop-2-enylsulfamoyl)benzoate Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 5-(allylsulfamoyl)-2-bromo-benzoate CAS Name: 2-bromo-5-(prop-2-enylsulfamoyl)benzoic acid (4,5-dimethoxy-2-methylphenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl 2-bromo-5-(prop-2-enylsulfamoyl)benzoate Traditional Name: 5-(allylsulfamoyl)-2-bromo-benzoic acid (4,5-dimethoxy-2-methyl-benzyl) ester Formula: C20H22BrNO6S MolecularWeight: 484.36078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1COC(=O)C2=C(C=CC(=C2)S(=O)(=O)NCC=C)Br)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1COC(=O)C2=C(C=CC(=C2)S(=O)(=O)NCC=C)Br)OC)OC

InChI

InChI=1S/C20H22BrNO6S/c1-5-8-22-29(24,25)15-6-7-17(21)16(11-15)20(23)28-12-14-10-19(27-4)18(26-3)9-13(14)2/h5-7,9-11,22H,1,8,12H2,2-4H3