Vitas-M small molecule compound

(2E)-2-(1,3-benzodioxol-5-yl)-3-(2,4-dimethoxy-5-nitrophenyl)prop-2-enenitrile

Catalog ID
STL436548
SMILES COc1cc(OC)c(cc1/C=C(\c1ccc2c(c1)OCO2)/C#N)[N+](=O)[O-]

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C18H14N2O6 MW 354.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O6/c1-23-16-8-17(24-2)14(20(21)22)6-12(16)5-13(9-19)11-3-4-15-18(7-11)26-10-25-15/h3-8H,10H2,1-2H3/b13-5-
InChIKey
XCBGYSBBPKAYSN-ACAGNQJTSA-N
Synonyms

(2E)2(13benzodioxol5yl)3(24dimethoxy5nitrophenyl)prop2enenitrile
(E)2(13BENZODIOXOL5YL)3(24DIMETHOXY5NITROPHENYL)PROP2ENENITRILE
COC1=CC(=C(C=C1C=C(C#N)C2=CC3=C(C=C2)OCO3)(N+)(=O)(O))OC
COc1cc(OC)c(cc1C=C(c1ccc2c(c1)OCO2)C#N)(N+)(=O)(O)
InChI=1SC18H14N2O6c12316817(242)14(20(21)22)612(16)513(919)11341518(711)26102515h38H10H212H3b135
MFCD05824573
ZINC000016362105
ZINC16362105

Check stock

See real-time availability and sample size for STL436548 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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