Vitas-M small molecule compound
1-(4,5-dimethoxy-2-nitrobenzyl)-6,7-dimethoxy-2-methylisoquinolinium
Catalog ID
STK664719
SMILES COc1cc([N+](=O)[O-])c(cc1OC)Cc1[n+](C)ccc2c1cc(OC)c(c2)OC
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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 C21H23N2O6 MW 399.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N2O6/c1-22-7-6-13-9-18(26-2)20(28-4)11-15(13)17(22)8-14-10-19(27-3)21(29-5)12-16(14)23(24)25/h6-7,9-12H,8H2,1-5H3/q+1InChIKey
DPSUVWUMRCTEAJ-UHFFFAOYSA-NSynonyms
1((45DIMETHOXY2NITROPHENYL)METHYL)67DIMETHOXY2METHYLISOQUINOLIN2IUM
1(45dimethoxy2nitrobenzyl)67dimethoxy2methylisoquinolinium
C(N+)1=C(C2=CC(=C(C=C2C=C1)OC)OC)CC3=CC(=C(C=C3(N+)(=O)(O))OC)OC
COc1cc((N+)(=O)(O))c(cc1OC)Cc1(n+)(C)ccc2c1cc(OC)c(c2)OC
InChI=1SC21H23N2O6c1227613918(262)20(284)1115(13)17(22)8141019(273)21(295)1216(14)23(24)25h67912H8H215H3q+1
ZINC000004727626
ZINC04727626
ZINC4727626
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