Vitas-M small molecule compound

1-(3-cyanopropyl)-6,7-dimethoxy-2,3,3-trimethyl-3,4-dihydroisoquinolinium

Catalog ID
STL552782
SMILES N#CCCCC1=[N+](C)C(Cc2c1cc(OC)c(c2)OC)(C)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 C18H25N2O2 MW 301.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N2O2/c1-18(2)12-13-10-16(21-4)17(22-5)11-14(13)15(20(18)3)8-6-7-9-19/h10-11H,6-8,12H2,1-5H3/q+1
InChIKey
DTVJLUUQSZVJKD-UHFFFAOYSA-N
Synonyms

1(3cyanopropyl)67dimethoxy233trimethyl34dihydroisoquinolin2iumiodide
1(3cyanopropyl)67dimethoxy233trimethyl34dihydroisoquinolinium
1600503
4(67dimethoxy233trimethyl4~(H)isoquinolin2ium1yl)butanenitrile
4(67DIMETHOXY233TRIMETHYL4HISOQUINOLIN2IUM1YL)BUTANENITRILE
InChI=1SC18H25N2O2c118(2)12131016(214)17(225)1114(13)15(20(18)3)867919h1011H6812H215H3q+1
N#CCCCC1=(N+)(C)C(Cc2c1cc(OC)c(c2)OC)(C)C(I)
ZINC000001820700
ZINC1820700

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Available files

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