2-hydroxyethyl 3-(acetamidomethyl)-5-[2-hydroxyethyl(2-oxidanylethanoyl)amino]-2,4,6-tris(iodanyl)benzoate

Systemtic Name: 2-hydroxyethyl 3-(acetamidomethyl)-5-[2-hydroxyethyl(2-oxidanylethanoyl)amino]-2,4,6-tris(iodanyl)benzoate Openeye Name: 2-hydroxyethyl 3-(acetamidomethyl)-5-[(2-hydroxyacetyl)-(2-hydroxyethyl)amino]-2,4,6-triiodo-benzoate CAS Name: 3-(acetamidomethyl)-5-[2-hydroxyethyl-(2-hydroxy-1-oxoethyl)amino]-2,4,6-triiodobenzoic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 3-(acetamidomethyl)-5-[(2-hydroxyacetyl)-(2-hydroxyethyl)amino]-2,4,6-triiodobenzoate Traditional Name: 3-(acetamidomethyl)-5-[glycoloyl(2-hydroxyethyl)amino]-2,4,6-triiodo-benzoic acid 2-hydroxyethyl ester Formula: C16H19I3N2O7 MolecularWeight: 732.04467

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=C(C(=C(C(=C1I)C(=O)OCCO)I)N(CCO)C(=O)CO)I

Isomeric SMILES

CC(=O)NCC1=C(C(=C(C(=C1I)C(=O)OCCO)I)N(CCO)C(=O)CO)I

InChI

InChI=1S/C16H19I3N2O7/c1-8(25)20-6-9-12(17)11(16(27)28-5-4-23)14(19)15(13(9)18)21(2-3-22)10(26)7-24/h22-24H,2-7H2,1H3,(H,20,25)