Products 80875-99-6

CAS 80875-99-6 is the registry number for (2S,3aS,7aS)-1-Benzoyl-octahydro-1H-indole-2-carboxylic acid. Offered by: Biosynth. Available pack sizes: 0,5g, 50mg.

(2S,3aS,7aS)-1-Benzoyl-octahydro-1H-indole-2-carboxylic acid
Biosynth
  • size: 0,5g, 50mg
  • Variants: 2
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Structural formula: {0} (CAS {1})

(2S,3aS,7aS)-1-benzoyl-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid (CAS 80875-99-6) is a chemical compound with the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. IUPAC name: (2S,3aS,7aS)-1-benzoyl-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid. InChIKey: GHOCRGGRRGZNJN-IHRRRGAJSA-N.

Identity
Molecular formulaC16H19NO3
Molecular weight273.33 g/mol
IUPAC name(2S,3aS,7aS)-1-benzoyl-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
InChIKeyGHOCRGGRRGZNJN-IHRRRGAJSA-N
SMILESC1CC[C@H]2[C@@H](C1)C[C@H](N2C(=O)C3=CC=CC=C3)C(=O)O

Computed by PubChem (NCBI)

Synonyms: (2S,3aS,7aS)-1-benzoyl-octahydro-1H-indole-2-carboxylic acid, (2S,3abeta,7abeta)-1-Benzoyloctahydro-1H-indole-2alpha-carboxylic acid, (2S,3aS,7aS)-1-benzoyl-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
Isomers (same molecular formula)
benzyl 3-oxo-9-azabicyclo[3.3.1]nonane-9-carboxylate C16H19NO3
1-(3-methoxypropyl)-2-methyl-5-phenylpyrrole-3-carboxylic acid C16H19NO3
ethyl 6-tert-butyl-4-oxo-1H-quinoline-3-carboxylate C16H19NO3
benzyl 2-oxo-7-azaspiro[3.5]nonane-7-carboxylate C16H19NO3
tert-butyl N-[[3-(furan-2-yl)phenyl]methyl]carbamate C16H19NO3
benzyl 3-formyl-8-azabicyclo[3.2.1]octane-8-carboxylate C16H19NO3
tert-butyl N-(5-hydroxy-6-methylnaphthalen-1-yl)carbamate C16H19NO3
[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methanamine C16H19NO3
benzyl (4aR,7aS)-7-oxo-3,4,4a,5,6,7a-hexahydro-1H-cyclopenta[c]pyridine-2-carboxylate C16H19NO3
tert-butyl (3aR,8bR)-4-oxo-1,3,3a,8b-tetrahydroindeno[1,2-c]pyrrole-2-carboxylate C16H19NO3
4-(1-adamantyl)-2-nitrophenol C16H19NO3
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-2,2-dimethylcyclopropane-1-carboxylic acid C16H19NO3