Vitas-M small molecule compound
ethyl 3-{5-[(E)-2-nitroethenyl]furan-2-yl}benzoate
Catalog ID
STL375768
SMILES CCOC(=O)c1cccc(c1)c1ccc(o1)/C=C/[N+](=O)[O-]
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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 C15H13NO5 MW 287.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NO5/c1-2-20-15(17)12-5-3-4-11(10-12)14-7-6-13(21-14)8-9-16(18)19/h3-10H,2H2,1H3/b9-8+InChIKey
IIYRYWPBOJWTEV-CMDGGOBGSA-NSynonyms
CCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)C=C(N+)(=O)(O)
CCOC(=O)c1cccc(c1)c1ccc(o1)C=C(N+)(=O)(O)
ethyl3(5((E)2nitroethenyl)furan2yl)benzoate
InChI=1SC15H13NO5c122015(17)1253411(1012)147613(2114)8916(18)19h310H2H21H3b98+
MFCD03716324
ZINC000000475275
ZINC00475275
ZINC475275
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