methanesulfonic acid;5-nitro-2-[4-[3-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)propylamino]butyl]benzo[de]isoquinoline-1,3-dione
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![methanesulfonic acid;5-nitro-2-[4-[3-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)propylamino]butyl]benzo[de]isoquinoline-1,3-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7c2c5ca13cd842aca12a072bf37fda56.png "methanesulfonic acid;5-nitro-2-[4-[3-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)propylamino]butyl]benzo[de]isoquinoline-1,3-dione")
methanesulfonic acid;5-nitro-2-[4-[3-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)propylamino]butyl]benzo[de]isoquinoline-1,3-dione
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CAS No:
153217-83-5
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Formula:
C32H29N5O11S
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Chemical Name:
methanesulfonic acid;5-nitro-2-[4-[3-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)propylamino]butyl]benzo[de]isoquinoline-1,3-dione
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Synonyms:
4-(3-(3-nitronaphthalene-1,8-dicarboximido)propylamino)-1-(3-nitronaphthalene-1,8-dicarboximido)butane hydromethanesulfonate;XB 596;XB-596;XB596;XB 596;153217-83-5;1H-Benze(de)isoquinoline-1,3(2H)-dione, 2-(3-((4-(5-nitro-1,3-dioxo-1H-benz(de)isoquinolin-2(3H)-yl)butyl)amino)propyl)-5-nitro-, monomethanesulfonate;ACMC-20c9kr;DTXSID20165286;XB596;XB-596;2-(3-((4-(5-Nitro-1,3-dioxo-1H-benz(de)isoquinolin-2(3H)-yl)butyl)amino)propyl)-5-nitro-1H-benze(de)isoquinoline-1,3(2H)-dione monomethanesulfonate;4-(3-(3-Nitronaphthalene-1,8-dicarboximido)propylamino)-1-(3-nitronaphthalene-1,8-dicarboximido)butane hydromethanesulfonate
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CAS No:
methanesulfonic acid;5-nitro-2-[4-[3-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)propylamino]butyl]benzo[de]isoquinoline-1,3-dione Basic Attributes
691.7 g/mol
691.15842793 g/mol
DTXSID20165286
Drug Information
4-(3-(3-nitronaphthalene-1,8-dicarboximido)propylamino)-1-(3-nitronaphthalene-1,8-dicarboximido)butane hydromethanesulfonate
Computed Properties
Molecular Weight:691.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:9
Exact Mass:691.15842793
Monoisotopic Mass:691.15842793
Topological Polar Surface Area:241
Heavy Atom Count:49
Complexity:1280
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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- Hot Searches
- coco3
- 1-butyne
- tert butanol
- 2-bromopropane
- 2-chlorobutane
- hydroxyacetophenone
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