Vitas-M small molecule compound

N,N-diethyl-3-methoxy-4-[(E)-2-nitroethenyl]aniline

Catalog ID
STL495217
SMILES CCN(c1ccc(c(c1)OC)/C=C/[N+](=O)[O-])CC

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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 C13H18N2O3 MW 250.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N2O3/c1-4-14(5-2)12-7-6-11(8-9-15(16)17)13(10-12)18-3/h6-10H,4-5H2,1-3H3/b9-8+
InChIKey
BEJWPUJOGOVSSD-CMDGGOBGSA-N
Synonyms

CCN(c1ccc(c(c1)OC)C=C(N+)(=O)(O))CC
CCN(CC)C1=CC(=C(C=C1)C=C(N+)(=O)(O))OC
InChI=1SC13H18N2O3c1414(52)127611(8915(16)17)13(1012)183h610H45H213H3b98+
MFCD05042065
NNdiethyl3methoxy4((E)2nitroethenyl)aniline
ZINC000034722226
ZINC34722226

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.