4-[[2-[(3-iodanylphenyl)carbonylamino]phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-[[2-[(3-iodanylphenyl)carbonylamino]phenyl]carbonylamino]benzoic acid Openeye Name: 4-[[2-[(3-iodobenzoyl)amino]benzoyl]amino]benzoic acid CAS Name: 4-[[[2-[[(3-iodophenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[2-[(3-iodobenzoyl)amino]benzoyl]amino]benzoic acid Traditional Name: 4-[[2-[(3-iodobenzoyl)amino]benzoyl]amino]benzoic acid Formula: C21H15IN2O4 MolecularWeight: 486.25927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)O)NC(=O)C3=CC(=CC=C3)I

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)O)NC(=O)C3=CC(=CC=C3)I

InChI

InChI=1S/C21H15IN2O4/c22-15-5-3-4-14(12-15)19(25)24-18-7-2-1-6-17(18)20(26)23-16-10-8-13(9-11-16)21(27)28/h1-12H,(H,23,26)(H,24,25)(H,27,28)