2-[[3,5-bis(chloranyl)-2-iodanyl-phenyl]carbonylamino]hexanoic acid

Systemtic Name: 2-[[3,5-bis(chloranyl)-2-iodanyl-phenyl]carbonylamino]hexanoic acid Openeye Name: 2-[(3,5-dichloro-2-iodo-benzoyl)amino]hexanoic acid CAS Name: 2-[[(3,5-dichloro-2-iodophenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[(3,5-dichloro-2-iodobenzoyl)amino]hexanoic acid Traditional Name: 2-[(3,5-dichloro-2-iodo-benzoyl)amino]hexanoic acid Formula: C13H14Cl2INO3 MolecularWeight: 430.06563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C1=CC(=CC(=C1I)Cl)Cl

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)C1=CC(=CC(=C1I)Cl)Cl

InChI

InChI=1S/C13H14Cl2INO3/c1-2-3-4-10(13(19)20)17-12(18)8-5-7(14)6-9(15)11(8)16/h5-6,10H,2-4H2,1H3,(H,17,18)(H,19,20)