(5-bromanyl-2-methoxy-phenyl)methyl 4-(oxolan-2-ylmethylsulfamoyl)benzoate

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl 4-(oxolan-2-ylmethylsulfamoyl)benzoate Openeye Name: (5-bromo-2-methoxy-phenyl)methyl 4-(tetrahydrofuran-2-ylmethylsulfamoyl)benzoate CAS Name: 4-(2-oxolanylmethylsulfamoyl)benzoic acid (5-bromo-2-methoxyphenyl)methyl ester IUPAC Name: (5-bromo-2-methoxyphenyl)methyl 4-(oxolan-2-ylmethylsulfamoyl)benzoate Traditional Name: 4-(tetrahydrofurfurylsulfamoyl)benzoic acid (5-bromo-2-methoxy-benzyl) ester Formula: C20H22BrNO6S MolecularWeight: 484.36078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3CCCO3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3CCCO3

InChI

InChI=1S/C20H22BrNO6S/c1-26-19-9-6-16(21)11-15(19)13-28-20(23)14-4-7-18(8-5-14)29(24,25)22-12-17-3-2-10-27-17/h4-9,11,17,22H,2-3,10,12-13H2,1H3