Vitas-M small molecule compound

2-(2-hydroxypropyl)-6,7-dimethoxy-1,2-dimethyl-1,2,3,4-tetrahydroisoquinolinium

Catalog ID
STL552645
SMILES COc1cc2c(cc1OC)CC[N+](C2C)(C)CC(O)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H26NO3 MW 280.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H26NO3/c1-11(18)10-17(3)7-6-13-8-15(19-4)16(20-5)9-14(13)12(17)2/h8-9,11-12,18H,6-7,10H2,1-5H3/q+1
InChIKey
CDGPCRFXVCWTDY-UHFFFAOYSA-N
Synonyms

(1S)2(2hydroxypropyl)67dimethoxy12dimethyl1234tetrahydroisoquinolin2iumiodide
1(67dimethoxy12dimethyl34dihydro1~(H)isoquinolin2ium2yl)propan2ol
1(67DIMETHOXY12DIMETHYL34DIHYDRO1HISOQUINOLIN2IUM2YL)PROPAN2OL
2(2hydroxypropyl)67dimethoxy12dimethyl1234tetrahydroisoquinolinium
3838753
COc1cc2c(cc1OC)CC(N+)((C@H)2C)(C)CC(O)C(I)
InChI=1SC16H26NO3c111(18)1017(3)7613815(194)16(205)914(13)12(17)2h89111218H6710H215H3q+1
ZINC000252441044
ZINC000252441047

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.