Vitas-M small molecule compound

N-(19-nitro-2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecin-18-yl)acetamide

Catalog ID
STL089775
SMILES CC(=O)Nc1cc2OCCOCCOCCOCCOCCOc2cc1[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 C18H26N2O9 MW 414.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N2O9/c1-14(21)19-15-12-17-18(13-16(15)20(22)23)29-11-9-27-7-5-25-3-2-24-4-6-26-8-10-28-17/h12-13H,2-11H2,1H3,(H,19,21)
InChIKey
MJNATMZXGBNIER-UHFFFAOYSA-N
Synonyms

CC(=O)NC1=CC2=C(C=C1(N+)(=O)(O))OCCOCCOCCOCCOCCO2
CC(=O)Nc1cc2OCCOCCOCCOCCOCCOc2cc1(N+)(=O)(O)
InChI=1SC18H26N2O9c114(21)1915121718(1316(15)20(22)23)29119277525322446268102817h1213H211H21H3(H1921)
MFCD00346778
N(19nitro23568911121415decahydro147101316benzohexaoxacyclooctadecin18yl)acetamide
N(20nitro258111417hexaoxabicyclo(1640)docosa1(18)1921trien21yl)acetamide
ZINC000006073741
ZINC06073741
ZINC6073741

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Available files

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