Vitas-M small molecule compound

2-(2,4-dimethoxyphenyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide

Catalog ID
STK594344
SMILES COc1cc(OC)ccc1c1c(C)[n+]([O-])c2c([n+]1[O-])CCCC2

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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 C17H20N2O4 MW 316.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4/c1-11-17(13-9-8-12(22-2)10-16(13)23-3)19(21)15-7-5-4-6-14(15)18(11)20/h8-10H,4-7H2,1-3H3
InChIKey
ODUCQWKUGWHZHE-UHFFFAOYSA-N
Synonyms
876868-57-4
2(24dimethoxyphenyl)3methyl4oxido5678tetrahydroquinoxalin1ium1oxide
2(24dimethoxyphenyl)3methyl5678tetrahydroquinoxaline14dioxide
876868574
CC1=C((N+)(=O)C2=C(N1(O))CCCC2)C3=C(C=C(C=C3)OC)OC
COc1cc(OC)ccc1c1c(C)(n+)((O))c2c((n+)1(O))CCCC2
InChI=1SC17H20N2O4c11117(139812(222)1016(13)233)19(21)15754614(15)18(11)20h810H47H213H3
MFCD06598125
ZINC000103704069
ZINC02213272
ZINC2213272

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Available files

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