2-[[3-[(4-iodophenyl)sulfamoyl]-4-methyl-phenyl]carbonylamino]benzoic acid

Systemtic Name: 2-[[3-[(4-iodophenyl)sulfamoyl]-4-methyl-phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[3-[(4-iodophenyl)sulfamoyl]-4-methyl-benzoyl]amino]benzoic acid CAS Name: 2-[[[3-[(4-iodophenyl)sulfamoyl]-4-methylphenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[3-[(4-iodophenyl)sulfamoyl]-4-methylbenzoyl]amino]benzoic acid Traditional Name: 2-[[3-[(4-iodophenyl)sulfamoyl]-4-methyl-benzoyl]amino]benzoic acid Formula: C21H17IN2O5S MolecularWeight: 536.33955

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)O)S(=O)(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)O)S(=O)(=O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C21H17IN2O5S/c1-13-6-7-14(20(25)23-18-5-3-2-4-17(18)21(26)27)12-19(13)30(28,29)24-16-10-8-15(22)9-11-16/h2-12,24H,1H3,(H,23,25)(H,26,27)