1-(3-iodanyl-4-oxidanyl-5-propyl-phenyl)-2-oxidanyl-ethanone

Systemtic Name: 1-(3-iodanyl-4-oxidanyl-5-propyl-phenyl)-2-oxidanyl-ethanone Openeye Name: 2-hydroxy-1-(4-hydroxy-3-iodo-5-propyl-phenyl)ethanone CAS Name: 2-hydroxy-1-(4-hydroxy-3-iodo-5-propylphenyl)ethanone IUPAC Name: 2-hydroxy-1-(4-hydroxy-3-iodo-5-propylphenyl)ethanone Traditional Name: 2-hydroxy-1-(4-hydroxy-3-iodo-5-propyl-phenyl)ethanone Formula: C11H13IO3 MolecularWeight: 320.12359

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC(=C1)C(=O)CO)I)O

Isomeric SMILES

CCCC1=C(C(=CC(=C1)C(=O)CO)I)O

InChI

InChI=1S/C11H13IO3/c1-2-3-7-4-8(10(14)6-13)5-9(12)11(7)15/h4-5,13,15H,2-3,6H2,1H3