3-[bis(phenylmethyl)sulfamoyl]-5-iodanyl-benzoic acid

Systemtic Name: 3-[bis(phenylmethyl)sulfamoyl]-5-iodanyl-benzoic acid Openeye Name: 3-(dibenzylsulfamoyl)-5-iodo-benzoic acid CAS Name: 3-[bis(phenylmethyl)sulfamoyl]-5-iodobenzoic acid IUPAC Name: 3-(dibenzylsulfamoyl)-5-iodobenzoic acid Traditional Name: 3-(dibenzylsulfamoyl)-5-iodo-benzoic acid Formula: C21H18INO4S MolecularWeight: 507.34139

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC(=CC(=C3)C(=O)O)I

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC(=CC(=C3)C(=O)O)I

InChI

InChI=1S/C21H18INO4S/c22-19-11-18(21(24)25)12-20(13-19)28(26,27)23(14-16-7-3-1-4-8-16)15-17-9-5-2-6-10-17/h1-13H,14-15H2,(H,24,25)