3-[3-[2-[2-[3-[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)anilino]-3-oxopropoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid
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![3-[3-[2-[2-[3-[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)anilino]-3-oxopropoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a05901276b9a4c22aa9d214201d9341e.png "3-[3-[2-[2-[3-[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)anilino]-3-oxopropoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid")
3-[3-[2-[2-[3-[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)anilino]-3-oxopropoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid
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CAS No:
51211-02-0
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Formula:
C28H28I6N4O11
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Chemical Name:
3-[3-[2-[2-[3-[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)anilino]-3-oxopropoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid
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Synonyms:
51211-02-0;BRN 2800767;Benzoic acid, 3,3'-(oxybis(ethyleneoxyethylenecarbonylimino))bis(5-(methylcarbamoyl)-2,4,6-triiodo-;DTXSID80965486;3,3'-{Oxybis[(ethane-2,1-diyl)oxy(1-hydroxyprop-3-yl-1-ylidene)azanylylidene]}bis{5-[hydroxy(methylimino)methyl]-2,4,6-triiodobenzoic acid}
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CAS No:
3-[3-[2-[2-[3-[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)anilino]-3-oxopropoxy]ethoxy]ethoxy]propanoylamino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid Basic Attributes
1358.0 g/mol
1357.6023 g/mol
Computed Properties
Molecular Weight:1358.0
XLogP3:2.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:18
Exact Mass:1357.6023
Monoisotopic Mass:1357.6023
Topological Polar Surface Area:219
Heavy Atom Count:49
Complexity:1090
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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