Vitas-M small molecule compound

N-[7-(2-methylpropanoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-4-nitrobenzamide

Catalog ID
STK163093
SMILES CC(C(=O)c1cc2OCCOc2cc1NC(=O)c1ccc(cc1)[N+](=O)[O-])C

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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 C19H18N2O6 MW 370.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O6/c1-11(2)18(22)14-9-16-17(27-8-7-26-16)10-15(14)20-19(23)12-3-5-13(6-4-12)21(24)25/h3-6,9-11H,7-8H2,1-2H3,(H,20,23)
InChIKey
DLDARXVAKUMOAK-UHFFFAOYSA-N
Synonyms

CC(C(=O)c1cc2OCCOc2cc1NC(=O)c1ccc(cc1)(N+)(=O)(O))C
CC(C)C(=O)C1=CC2=C(C=C1NC(=O)C3=CC=C(C=C3)(N+)(=O)(O))OCCO2
InChI=1SC19H18N2O6c111(2)18(22)1491617(27872616)1015(14)2019(23)123513(6412)21(24)25h36911H78H212H3(H2023)
MFCD06003309
N(7(2METHYLPROPANOYL)23DIHYDRO14BENZODIOXIN6YL)4NITROBENZAMIDE
ZINC000001049642
ZINC01049642
ZINC1049642

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Available files

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