5,5-bis(fluoranyl)-5-(5-iodanyl-2-methoxy-phenyl)pentanoate

Systemtic Name: 5,5-bis(fluoranyl)-5-(5-iodanyl-2-methoxy-phenyl)pentanoate Openeye Name: 5,5-difluoro-5-(5-iodo-2-methoxy-phenyl)pentanoate CAS Name: 5,5-difluoro-5-(5-iodo-2-methoxyphenyl)pentanoate IUPAC Name: 5,5-difluoro-5-(5-iodo-2-methoxyphenyl)pentanoate Traditional Name: 5,5-difluoro-5-(5-iodo-2-methoxy-phenyl)valerate Formula: C12H12F2IO3- MolecularWeight: 369.123156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)I)C(CCCC(=O)[O-])(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)I)C(CCCC(=O)[O-])(F)F

InChI

InChI=1S/C12H13F2IO3/c1-18-10-5-4-8(15)7-9(10)12(13,14)6-2-3-11(16)17/h4-5,7H,2-3,6H2,1H3,(H,16,17)/p-1