Vitas-M small molecule compound
dimethyl (4-hydroxy-3-methoxy-5-nitrobenzylidene)propanedioate
Catalog ID
STL506556
SMILES COC(=O)C(=Cc1cc(OC)c(c(c1)[N+](=O)[O-])O)C(=O)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 C13H13NO8 MW 311.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13NO8/c1-20-10-6-7(5-9(11(10)15)14(18)19)4-8(12(16)21-2)13(17)22-3/h4-6,15H,1-3H3InChIKey
HUDFMIAEJVASQA-UHFFFAOYSA-NSynonyms
869393
dimethyl(4hydroxy3methoxy5nitrobenzylidene)propanedioate
DIMETHYL2((4HYDROXY3METHOXY5NITROPHENYL)METHYLIDENE)PROPANEDIOATE
InChI=1SC13H13NO8c1201067(59(11(10)15)14(18)19)48(12(16)212)13(17)223h4615H13H3
MFCD01442647
ZINC000035391944
ZINC35391944
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