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

Systemtic Name: 5-iodanyl-2-[[4-(propanoylamino)phenyl]carbonylamino]benzoic acid Openeye Name: 5-iodo-2-[[4-(propanoylamino)benzoyl]amino]benzoic acid CAS Name: 5-iodo-2-[[oxo-[4-(1-oxopropylamino)phenyl]methyl]amino]benzoic acid IUPAC Name: 5-iodo-2-[[4-(propanoylamino)benzoyl]amino]benzoic acid Traditional Name: 5-iodo-2-[(4-propionamidobenzoyl)amino]benzoic acid Formula: C17H15IN2O4 MolecularWeight: 438.21647

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)I)C(=O)O

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)I)C(=O)O

InChI

InChI=1S/C17H15IN2O4/c1-2-15(21)19-12-6-3-10(4-7-12)16(22)20-14-8-5-11(18)9-13(14)17(23)24/h3-9H,2H2,1H3,(H,19,21)(H,20,22)(H,23,24)