2-[(5-chloranyl-4-iodanyl-2-methoxy-phenyl)carbonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[(5-chloranyl-4-iodanyl-2-methoxy-phenyl)carbonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(5-chloro-4-iodo-2-methoxy-benzoyl)amino]-3-methyl-butanoic acid CAS Name: 2-[[(5-chloro-4-iodo-2-methoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[(5-chloro-4-iodo-2-methoxybenzoyl)amino]-3-methylbutanoic acid Traditional Name: 2-[(5-chloro-4-iodo-2-methoxy-benzoyl)amino]-3-methyl-butyric acid Formula: C13H15ClINO4 MolecularWeight: 411.61997

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC(=C(C=C1OC)I)Cl

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=CC(=C(C=C1OC)I)Cl

InChI

InChI=1S/C13H15ClINO4/c1-6(2)11(13(18)19)16-12(17)7-4-8(14)9(15)5-10(7)20-3/h4-6,11H,1-3H3,(H,16,17)(H,18,19)