1H-Benzimidazolium, 5-(ethoxycarbonyl)-2-[3-[5-(ethoxycarbonyl)-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]-1-propen-1-yl]-1-ethyl-3-(3-sulfopropyl)-, inner salt
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![1H-Benzimidazolium, 5-(ethoxycarbonyl)-2-[3-[5-(ethoxycarbonyl)-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]-1-propen-1-yl]-1-ethyl-3-(3-sulfopropyl)-, inner salt structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a07674c974e94762a7f42b389d24ff15.png "1H-Benzimidazolium, 5-(ethoxycarbonyl)-2-[3-[5-(ethoxycarbonyl)-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]-1-propen-1-yl]-1-ethyl-3-(3-sulfopropyl)-, inner salt")
1H-Benzimidazolium, 5-(ethoxycarbonyl)-2-[3-[5-(ethoxycarbonyl)-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]-1-propen-1-yl]-1-ethyl-3-(3-sulfopropyl)-, inner salt
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CAS No:
32634-40-5
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Formula:
C32H40N4O7S
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Chemical Name:
1H-Benzimidazolium, 5-(ethoxycarbonyl)-2-[3-[5-(ethoxycarbonyl)-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]-1-propen-1-yl]-1-ethyl-3-(3-sulfopropyl)-, inner salt
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Synonyms:
1H-Benzimidazolium,5-(ethoxycarbonyl)-2-[3-[5-(ethoxycarbonyl)-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]-1-propen-1-yl]-1-ethyl-3-(3-sulfopropyl)-,inner salt;1H-Benzimidazolium,5-(ethoxycarbonyl)-3-[3-[5-(ethoxycarbonyl)-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]-1-propenyl]-1-ethyl-3-(3-sulfopropyl)-,inner salt;Benzimidazolium,5-carboxy-2-[3-(5-carboxy-1,3-diethyl-2-benzimidazolinylidene)propenyl]-1-ethyl-3-(3-sulfopropyl)-,hydroxide,inner salt,2,5-diethyl ester;1,1′,3′-Triethyl-3-γ-sulfopropyl-5,5′-diethoxyimidacarbocyanine betaine;81344-07-2
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CAS No:
1H-Benzimidazolium, 5-(ethoxycarbonyl)-2-[3-[5-(ethoxycarbonyl)-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]-1-propen-1-yl]-1-ethyl-3-(3-sulfopropyl)-, inner salt Basic Attributes
624.75
624.261771
Computed Properties
Molecular Weight:624.7
XLogP3:4.9
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:14
Exact Mass:624.26177080
Monoisotopic Mass:624.26177080
Topological Polar Surface Area:134
Heavy Atom Count:44
Complexity:1140
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1H-Benzimidazolium, 5-(ethoxycarbonyl)-2-[3-[5-(ethoxycarbonyl)-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]-1-propen-1-yl]-1-ethyl-3-(3-sulfopropyl)-, inner salt
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