5-[[[2-bromanyl-5-(diethylsulfamoyl)phenyl]carbonylamino]methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[[[2-bromanyl-5-(diethylsulfamoyl)phenyl]carbonylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[[2-bromo-5-(diethylsulfamoyl)benzoyl]amino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[[2-bromo-5-(diethylsulfamoyl)phenyl]-oxomethyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[[2-bromo-5-(diethylsulfamoyl)benzoyl]amino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[[2-bromo-5-(diethylsulfamoyl)benzoyl]amino]methyl]-2-methoxy-benzoic acid Formula: C20H23BrN2O6S MolecularWeight: 499.37542

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C20H23BrN2O6S/c1-4-23(5-2)30(27,28)14-7-8-17(21)15(11-14)19(24)22-12-13-6-9-18(29-3)16(10-13)20(25)26/h6-11H,4-5,12H2,1-3H3,(H,22,24)(H,25,26)