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4-butoxy-3-ethoxy-5-iodanyl-benzoate

4-butoxy-3-ethoxy-5-iodanyl-benzoate

Systemtic Name:4-butoxy-3-ethoxy-5-iodanyl-benzoate
Openeye Name:4-butoxy-3-ethoxy-5-iodo-benzoate
CAS Name:4-butoxy-3-ethoxy-5-iodobenzoate
IUPAC Name:4-butoxy-3-ethoxy-5-iodobenzoate
Traditional Name:4-butoxy-3-ethoxy-5-iodo-benzoate
Formula: C13H16IO4-
MolecularWeight: 363.16821
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1I)C(=O)[O-])OCC


Isomeric SMILES

CCCCOC1=C(C=C(C=C1I)C(=O)[O-])OCC


InChI

InChI=1S/C13H17IO4/c1-3-5-6-18-12-10(14)7-9(13(15)16)8-11(12)17-4-2/h7-8H,3-6H2,1-2H3,(H,15,16)/p-1


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