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

Systemtic Name: 2-[(5-bromanyl-2-iodanyl-phenyl)carbonylamino]-3-methyl-pentanoic acid Openeye Name: 2-[(5-bromo-2-iodo-benzoyl)amino]-3-methyl-pentanoic acid CAS Name: 2-[[(5-bromo-2-iodophenyl)-oxomethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[(5-bromo-2-iodobenzoyl)amino]-3-methylpentanoic acid Traditional Name: 2-[(5-bromo-2-iodo-benzoyl)amino]-3-methyl-valeric acid Formula: C13H15BrINO3 MolecularWeight: 440.07157

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrINO3/c1-3-7(2)11(13(18)19)16-12(17)9-6-8(14)4-5-10(9)15/h4-7,11H,3H2,1-2H3,(H,16,17)(H,18,19)