Vitas-M small molecule compound
2,3-dimethoxy-6-{(E)-[2-(quinolin-2-yl)diazan-2-ium-1-ylidene]methyl}benzoate
Catalog ID
STL039864
SMILES COc1ccc(c(c1OC)C(=O)[O-])/C=N/[NH2+]c1ccc2c(n1)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 C19H17N3O4 MW 351.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O4/c1-25-15-9-7-13(17(19(23)24)18(15)26-2)11-20-22-16-10-8-12-5-3-4-6-14(12)21-16/h3-11H,1-2H3,(H,21,22)(H,23,24)/b20-11+InChIKey
ZTFMENFOJOCGHM-RGVLZGJSSA-NSynonyms
384359-73-323dimethoxy6((E)(2(quinolin2yl)diazan2ium1ylidene)methyl)benzoate
23dimethoxy6((E)(quinolin2ylhydrazinylidene)methyl)benzoicacid
384359733
COC1=C(C(=C(C=C1)C=NNC2=NC3=CC=CC=C3C=C2)C(=O)O)OC
COc1ccc(c(c1OC)C(=O)(O))C=N(NH2+)c1ccc2c(n1)cccc2
InChI=1SC19H17N3O4c125159713(17(19(23)24)18(15)262)1120221610812534614(12)2116h311H12H3(H2122)(H2324)b2011+
MFCD03283726
ZINC000004869519
ZINC33526222
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