[[3-aminocarbonyl-2,4,6-tris(iodanyl)phenyl]-ethyl-carbamoyl]oxymethyl ethanoate

Systemtic Name: [[3-aminocarbonyl-2,4,6-tris(iodanyl)phenyl]-ethyl-carbamoyl]oxymethyl ethanoate Openeye Name: [(3-carbamoyl-2,4,6-triiodo-phenyl)-ethyl-carbamoyl]oxymethyl acetate CAS Name: acetic acid [(3-carbamoyl-N-ethyl-2,4,6-triiodoanilino)-oxomethoxy]methyl ester IUPAC Name: [(3-carbamoyl-2,4,6-triiodophenyl)-ethylcarbamoyl]oxymethyl acetate Traditional Name: acetic acid [(3-carbamoyl-2,4,6-triiodo-phenyl)-ethyl-carbamoyl]oxymethyl ester Formula: C13H13I3N2O5 MolecularWeight: 657.96613

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=C(C(=C1I)C(=O)N)I)I)C(=O)OCOC(=O)C

Isomeric SMILES

CCN(C1=C(C=C(C(=C1I)C(=O)N)I)I)C(=O)OCOC(=O)C

InChI

InChI=1S/C13H13I3N2O5/c1-3-18(13(21)23-5-22-6(2)19)11-8(15)4-7(14)9(10(11)16)12(17)20/h4H,3,5H2,1-2H3,(H2,17,20)