5-(5-iodanyl-2-methoxy-phenyl)pentanoate

Systemtic Name: 5-(5-iodanyl-2-methoxy-phenyl)pentanoate Openeye Name: 5-(5-iodo-2-methoxy-phenyl)pentanoate CAS Name: 5-(5-iodo-2-methoxyphenyl)pentanoate IUPAC Name: 5-(5-iodo-2-methoxyphenyl)pentanoate Traditional Name: 5-(5-iodo-2-methoxy-phenyl)valerate Formula: C12H14IO3- MolecularWeight: 333.14223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)I)CCCCC(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)I)CCCCC(=O)[O-]

InChI

InChI=1S/C12H15IO3/c1-16-11-7-6-10(13)8-9(11)4-2-3-5-12(14)15/h6-8H,2-5H2,1H3,(H,14,15)/p-1