3-[[4-[[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl]benzoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid
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![3-[[4-[[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl]benzoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7bba410607a44055802ebd73ed9ee874.png "3-[[4-[[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl]benzoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid")
3-[[4-[[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl]benzoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid
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CAS No:
13013-78-0
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Formula:
C26H16I6N4O8
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Chemical Name:
3-[[4-[[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl]benzoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid
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Synonyms:
BRN 2800390;Isophthalamic acid, 5,5"-(1,4-phenylenebis(carbonylimino))bis(N-methyl-2,4,6-triiodo-;5,5"-(1,4-Phenylenebis(carbonylimino))bis(N-methyl-2,4,6-triiodoisophthalamic acid);CTK4B6543;DTXSID50156364;LS-85203;5,5"-(Terephthaloyldiimino)bis[2,4,6-triiodo-N-methylisophthalamic acid];Isophthalamic acid,5,5"-(terephthaloyldiimino)bis[2,4,6-triiodo-N-methyl- (7CI,8CI)
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CAS No:
3-[[4-[[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl]benzoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid Basic Attributes
1273.861
1273.524
DTXSID50156364
Computed Properties
Molecular Weight:1273.9
XLogP3:5.1
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:1273.5236
Monoisotopic Mass:1273.5236
Topological Polar Surface Area:191
Heavy Atom Count:44
Complexity:1060
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-[[4-[[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)phenyl]carbamoyl]benzoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid
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