2-[3-(carboxymethyl)-5-ethanoyl-2-iodyl-phenyl]ethanoic acid

Systemtic Name: 2-[3-(carboxymethyl)-5-ethanoyl-2-iodyl-phenyl]ethanoic acid Openeye Name: 2-[5-acetyl-3-(carboxymethyl)-2-iodyl-phenyl]acetic acid CAS Name: 2-[5-acetyl-3-(carboxymethyl)-2-iodylphenyl]acetic acid IUPAC Name: 2-[5-acetyl-3-(carboxymethyl)-2-iodylphenyl]acetic acid Traditional Name: 2-[5-acetyl-3-(carboxymethyl)-2-iodyl-phenyl]acetic acid Formula: C12H11IO7 MolecularWeight: 394.11601

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11IO7/c1-6(14)7-2-8(4-10(15)16)12(13(19)20)9(3-7)5-11(17)18/h2-3H,4-5H2,1H3,(H,15,16)(H,17,18)