Vitas-M small molecule compound

15-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine

Catalog ID
STL089777
SMILES [O-][N+](=O)c1ccc2c(c1)OCCOCCOCCOCCO2

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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 C14H19NO7 MW 313.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19NO7/c16-15(17)12-1-2-13-14(11-12)22-10-8-20-6-4-18-3-5-19-7-9-21-13/h1-2,11H,3-10H2
InChIKey
XIWRBQVYCZCEPG-UHFFFAOYSA-N
Synonyms
60835-69-0
(4NITROBENZO)15CROWN5
(O)(N+)(=O)c1ccc2c(c1)OCCOCCOCCOCCO2
15nitro2356891112octahydro1471013benzopentaoxacyclopentadecine
17nitro2581114pentaoxabicyclo(1340)nonadeca1(15)1618triene
4NITROBENZO15CROWN5
4NITROBENZO15CROWN5ETHER
60835690
C1COCCOC2=C(C=C(C=C2)(N+)(=O)(O))OCCOCCO1
InChI=1SC14H19NO7c1615(17)12121314(1112)221082064183519792113h1211H310H2
MFCD00060713
NITROBENZO15CROWN5
ZINC000003895786
ZINC03895786
ZINC3895786

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Available files

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