3-[(5-bromanyl-2-iodanyl-phenyl)carbonylamino]butanoic acid

Systemtic Name: 3-[(5-bromanyl-2-iodanyl-phenyl)carbonylamino]butanoic acid Openeye Name: 3-[(5-bromo-2-iodo-benzoyl)amino]butanoic acid CAS Name: 3-[[(5-bromo-2-iodophenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 3-[(5-bromo-2-iodobenzoyl)amino]butanoic acid Traditional Name: 3-[(5-bromo-2-iodo-benzoyl)amino]butyric acid Formula: C11H11BrINO3 MolecularWeight: 412.01841

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)C1=C(C=CC(=C1)Br)I

Isomeric SMILES

CC(CC(=O)O)NC(=O)C1=C(C=CC(=C1)Br)I

InChI

InChI=1S/C11H11BrINO3/c1-6(4-10(15)16)14-11(17)8-5-7(12)2-3-9(8)13/h2-3,5-6H,4H2,1H3,(H,14,17)(H,15,16)