Products 94062-52-9

CAS 94062-52-9 appears in our catalog under these names: L-Octahydroindole-2-carboxylic acid benzyl ester 4-methylbenzenesulfonate, 95%, Perindopril Impurity 23, L-(2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid benzyl ester tosylate salt, (2S,3aS,7aS)-Benzyl octahydro-1H-indole-2-carboxylate 4-methylbenzenesulfonate 95%, (2S,3aS,7aS)-Benzyl octahydro-1H-indole-2-carboxylate 4-methylbenzenesulfonate, 95%, 95%. Offered by: Combi-blocks, Chemat Brand, Biosynth, Ambeed, Chemat. Available pack sizes: 5g, 1g, on request, 2g, 10g, 25g.

Structural formula: {0} (CAS {1})

Benzyl (2S,3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylate;4-methylbenzenesulfonic acid (CAS 94062-52-9) is a chemical compound with the molecular formula C23H29NO5S and a molecular weight of 431.5 g/mol. IUPAC name: benzyl (2S,3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylate;4-methylbenzenesulfonic acid. InChIKey: PTLASYHTXGUCJU-WDTSGDEMSA-N.

Identity
Molecular formulaC23H29NO5S
Molecular weight431.5 g/mol
IUPAC namebenzyl (2S,3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylate;4-methylbenzenesulfonic acid
InChIKeyPTLASYHTXGUCJU-WDTSGDEMSA-N
SMILESCC1=CC=C(C=C1)S(=O)(=O)O.C1CC[C@H]2[C@@H](C1)C[C@H](N2)C(=O)OCC3=CC=CC=C3

Computed by PubChem (NCBI)