ethoxymethyl 2-[[3-azanyl-2,4,6-tris(iodanyl)phenyl]carbonyl-phenyl-amino]propanoate

Systemtic Name: ethoxymethyl 2-[[3-azanyl-2,4,6-tris(iodanyl)phenyl]carbonyl-phenyl-amino]propanoate Openeye Name: ethoxymethyl 2-(N-(3-amino-2,4,6-triiodo-benzoyl)anilino)propanoate CAS Name: 2-(N-[(3-amino-2,4,6-triiodophenyl)-oxomethyl]anilino)propanoic acid ethoxymethyl ester IUPAC Name: ethoxymethyl 2-(N-(3-amino-2,4,6-triiodobenzoyl)anilino)propanoate Traditional Name: 2-(N-(3-amino-2,4,6-triiodo-benzoyl)anilino)propionic acid ethoxymethyl ester Formula: C19H19I3N2O4 MolecularWeight: 720.07857

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Descriptors Computed from Structure

Canonical SMILES:

CCOCOC(=O)C(C)N(C1=CC=CC=C1)C(=O)C2=C(C(=C(C=C2I)I)N)I

Isomeric SMILES

CCOCOC(=O)C(C)N(C1=CC=CC=C1)C(=O)C2=C(C(=C(C=C2I)I)N)I

InChI

InChI=1S/C19H19I3N2O4/c1-3-27-10-28-19(26)11(2)24(12-7-5-4-6-8-12)18(25)15-13(20)9-14(21)17(23)16(15)22/h4-9,11H,3,10,23H2,1-2H3