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ethyl 6-[3-azanyl-2,4,6-tris(iodanyl)phenyl]hexanoate

ethyl 6-[3-azanyl-2,4,6-tris(iodanyl)phenyl]hexanoate

Systemtic Name:ethyl 6-[3-azanyl-2,4,6-tris(iodanyl)phenyl]hexanoate
Openeye Name:ethyl 6-(3-amino-2,4,6-triiodo-phenyl)hexanoate
CAS Name:6-(3-amino-2,4,6-triiodophenyl)hexanoic acid ethyl ester
IUPAC Name:ethyl 6-(3-amino-2,4,6-triiodophenyl)hexanoate
Traditional Name:6-(3-amino-2,4,6-triiodo-phenyl)hexanoic acid ethyl ester
Formula: C14H18I3NO2
MolecularWeight: 613.01163
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCC1=C(C(=C(C=C1I)I)N)I


Isomeric SMILES

CCOC(=O)CCCCCC1=C(C(=C(C=C1I)I)N)I


InChI

InChI=1S/C14H18I3NO2/c1-2-20-12(19)7-5-3-4-6-9-10(15)8-11(16)14(18)13(9)17/h8H,2-7,18H2,1H3


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