5-iodanyl-2-[[4-(4-nitrophenoxy)phenyl]carbonylamino]benzoic acid

Systemtic Name: 5-iodanyl-2-[[4-(4-nitrophenoxy)phenyl]carbonylamino]benzoic acid Openeye Name: 5-iodo-2-[[4-(4-nitrophenoxy)benzoyl]amino]benzoic acid CAS Name: 5-iodo-2-[[[4-(4-nitrophenoxy)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 5-iodo-2-[[4-(4-nitrophenoxy)benzoyl]amino]benzoic acid Traditional Name: 5-iodo-2-[[4-(4-nitrophenoxy)benzoyl]amino]benzoic acid Formula: C20H13IN2O6 MolecularWeight: 504.23149

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)I)C(=O)O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)I)C(=O)O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H13IN2O6/c21-13-3-10-18(17(11-13)20(25)26)22-19(24)12-1-6-15(7-2-12)29-16-8-4-14(5-9-16)23(27)28/h1-11H,(H,22,24)(H,25,26)