tert-butyl (6R,7S)-3-(acetyloxymethyl)-7-chloro-5,5,8-trioxo-5λ6-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
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tert-butyl (6R,7S)-3-(acetyloxymethyl)-7-chloro-5,5,8-trioxo-5λ6-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
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CAS No:
95672-01-8
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Formula:
C14H18ClNO7S
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Chemical Name:
tert-butyl (6R,7S)-3-(acetyloxymethyl)-7-chloro-5,5,8-trioxo-5λ6-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
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Synonyms:
3-acetoxymethyl-7-chloro-3-cephem-4-carboxylate-1,1-dioxide tert-butylester;AMCCCDB;CHEMBL314476;Amcccdb;95672-01-8;SCHEMBL8671201;DTXSID60914876;BDBM50015885;t-butyl 7alpha-chloro-3-acetoxymethyl-3-cephem-4-carboxylate-1,1-dioxide;3-(Acetoxymethyl)-4-(tert-butyloxycarbonyl)-7alpha-chlorocepham-3-ene 1,1-dioxide;3-Acetoxymethyl-7-chloro-3-cephem-4-carboxylate-1,1-dioxide tert-butylester;3-Acetoxymethyl-7-chloro-5,5,8-trioxo-5lambda*6*-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester;5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-7-chloro-8-oxo-, 1,1-dimethylethyl ester, 5,5-doxide, (6R-cis)-;tert-butyl (6R,7S)-3-(acetyloxymethyl)-7-chloro-5,5,8-trioxo-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate;tert-Butyl 3-[(acetyloxy)methyl]-7-chloro-5,5,8-trioxo-5lambda~6~-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
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CAS No:
tert-butyl (6R,7S)-3-(acetyloxymethyl)-7-chloro-5,5,8-trioxo-5λ6-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Basic Attributes
379.8 g/mol
379.0492508 g/mol
Computed Properties
Molecular Weight:379.8
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:379.0492508
Monoisotopic Mass:379.0492508
Topological Polar Surface Area:115
Heavy Atom Count:24
Complexity:729
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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