ethyl 7-[3-azanyl-2,4,6-tris(iodanyl)phenyl]heptanoate

Systemtic Name: ethyl 7-[3-azanyl-2,4,6-tris(iodanyl)phenyl]heptanoate Openeye Name: ethyl 7-(3-amino-2,4,6-triiodo-phenyl)heptanoate CAS Name: 7-(3-amino-2,4,6-triiodophenyl)heptanoic acid ethyl ester IUPAC Name: ethyl 7-(3-amino-2,4,6-triiodophenyl)heptanoate Traditional Name: 7-(3-amino-2,4,6-triiodo-phenyl)enanthic acid ethyl ester Formula: C15H20I3NO2 MolecularWeight: 627.03821

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCC1=C(C(=C(C=C1I)I)N)I

Isomeric SMILES

CCOC(=O)CCCCCCC1=C(C(=C(C=C1I)I)N)I

InChI

InChI=1S/C15H20I3NO2/c1-2-21-13(20)8-6-4-3-5-7-10-11(16)9-12(17)15(19)14(10)18/h9H,2-8,19H2,1H3