Basic Information |
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Product Name: | L-OCTAHYDROINDOLE-2-CARBOXYLIC ACID BENZYL ESTER 4-METHYLBENZENESULFONATE |
CAS: | 94062-52-9 |
English Synonyms: | L-OCTAHYDROINDOLE-2-CARBOXYLIC ACID BENZYL ESTER 4-METHYLBENZENESULFONATE ; 2S-(2ALPHA,3ALPHA,BETA,7ALPHA,BETA-OCTAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID PHENYL METHYL ESTER ; BENZYL(2S,3AS,7AS)-OCTAHYDRO-1H-INDOLE-2-CARBOXYLATE 4-METHYLBENEZENESULFONATE |
MDL Number.: | MFCD09751101 |
H bond acceptor: | 3 |
H bond donor: | 1 |
Smile: | Cc1ccc(cc1)S(=O)(=O)O.c1ccc(cc1)COC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2 |
InChi: | InChI=1S/C16H21NO2.C7H8O3S/c18-16(19-11-12-6-2-1-3-7-12)15-10-13-8-4-5-9-14(13)17-15;1-6-2-4-7(5-3-6)11(8,9)10/h1-3,6-7,13-15,17H,4-5,8-11H2;2-5H,1H3,(H,8,9,10)/t13-,14-,15-;/m0./s1 |
InChiKey: | InChIKey=PTLASYHTXGUCJU-WDTSGDEMSA-N |
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