5-(5-iodanyl-2-methoxy-phenyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(5-iodanyl-2-methoxy-phenyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(5-iodo-2-methoxy-phenyl)-5-oxo-pentanoic acid CAS Name: 5-(5-iodo-2-methoxyphenyl)-5-oxopentanoic acid IUPAC Name: 5-(5-iodo-2-methoxyphenyl)-5-oxopentanoic acid Traditional Name: 5-(5-iodo-2-methoxy-phenyl)-5-keto-valeric acid Formula: C12H13IO4 MolecularWeight: 348.13369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)I)C(=O)CCCC(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)I)C(=O)CCCC(=O)O

InChI

InChI=1S/C12H13IO4/c1-17-11-6-5-8(13)7-9(11)10(14)3-2-4-12(15)16/h5-7H,2-4H2,1H3,(H,15,16)