2-[[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]sulfamoyl]benzoic acid

Systemtic Name: 2-[[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]sulfamoyl]benzoic acid Openeye Name: 2-[[3-(4-bromophenoxy)-2-hydroxy-propyl]sulfamoyl]benzoic acid CAS Name: 2-[[3-(4-bromophenoxy)-2-hydroxypropyl]sulfamoyl]benzoic acid IUPAC Name: 2-[[3-(4-bromophenoxy)-2-hydroxypropyl]sulfamoyl]benzoic acid Traditional Name: 2-[[3-(4-bromophenoxy)-2-hydroxy-propyl]sulfamoyl]benzoic acid Formula: C16H16BrNO6S MolecularWeight: 430.27034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)NCC(COC2=CC=C(C=C2)Br)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)NCC(COC2=CC=C(C=C2)Br)O

InChI

InChI=1S/C16H16BrNO6S/c17-11-5-7-13(8-6-11)24-10-12(19)9-18-25(22,23)15-4-2-1-3-14(15)16(20)21/h1-8,12,18-19H,9-10H2,(H,20,21)