3-[[5-iodanyl-2-(methylamino)phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[5-iodanyl-2-(methylamino)phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[5-iodo-2-(methylamino)benzoyl]amino]propanoic acid CAS Name: 3-[[[5-iodo-2-(methylamino)phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[5-iodo-2-(methylamino)benzoyl]amino]propanoic acid Traditional Name: 3-[[5-iodo-2-(methylamino)benzoyl]amino]propionic acid Formula: C11H13IN2O3 MolecularWeight: 348.13699

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)I)C(=O)NCCC(=O)O

Isomeric SMILES

CNC1=C(C=C(C=C1)I)C(=O)NCCC(=O)O

InChI

InChI=1S/C11H13IN2O3/c1-13-9-3-2-7(12)6-8(9)11(17)14-5-4-10(15)16/h2-3,6,13H,4-5H2,1H3,(H,14,17)(H,15,16)