4-azanyl-2-[(5-chloranyl-4-iodanyl-2-methoxy-phenyl)carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[(5-chloranyl-4-iodanyl-2-methoxy-phenyl)carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[(5-chloro-4-iodo-2-methoxy-benzoyl)amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[(5-chloro-4-iodo-2-methoxyphenyl)-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[(5-chloro-4-iodo-2-methoxybenzoyl)amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[(5-chloro-4-iodo-2-methoxy-benzoyl)amino]-4-keto-butyric acid Formula: C12H12ClIN2O5 MolecularWeight: 426.59155

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC(CC(=O)N)C(=O)O)Cl)I

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC(CC(=O)N)C(=O)O)Cl)I

InChI

InChI=1S/C12H12ClIN2O5/c1-21-9-3-7(14)6(13)2-5(9)11(18)16-8(12(19)20)4-10(15)17/h2-3,8H,4H2,1H3,(H2,15,17)(H,16,18)(H,19,20)