Vitas-M small molecule compound

(2E)-N-(3,4-dimethoxyphenyl)-3-(5-nitrofuran-2-yl)prop-2-enamide

Catalog ID
STL172916
SMILES COc1cc(ccc1OC)NC(=O)/C=C/c1ccc(o1)[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 C15H14N2O6 MW 318.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N2O6/c1-21-12-6-3-10(9-13(12)22-2)16-14(18)7-4-11-5-8-15(23-11)17(19)20/h3-9H,1-2H3,(H,16,18)/b7-4+
InChIKey
YLWBVXGVIGZBCG-QPJJXVBHSA-N
Synonyms
495375-49-0
(2E)N(34dimethoxyphenyl)3(5nitrofuran2yl)prop2enamide
(E)N(34DIMETHOXYPHENYL)3(5NITROFURAN2YL)PROP2ENAMIDE
495375490
COC1=C(C=C(C=C1)NC(=O)C=CC2=CC=C(O2)(N+)(=O)(O))OC
COc1cc(ccc1OC)NC(=O)C=Cc1ccc(o1)(N+)(=O)(O)
InChI=1SC15H14N2O6c121126310(913(12)222)1614(18)74115815(2311)17(19)20h39H12H3(H1618)b74+
MFCD02174866
ZINC000000999787
ZINC00999787
ZINC999787

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Available files

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