Vitas-M small molecule compound

1,1'-(1,5,3,7-dioxadiazocane-3,7-diyldibenzene-4,1-diyl)diethanone

Catalog ID
STK877425
SMILES CC(=O)c1ccc(cc1)N1COCN(COC1)c1ccc(cc1)C(=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 C20H22N2O4 MW 354.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4/c1-15(23)17-3-7-19(8-4-17)21-11-25-13-22(14-26-12-21)20-9-5-18(6-10-20)16(2)24/h3-10H,11-14H2,1-2H3
InChIKey
OLTVTQHPOGHIJL-UHFFFAOYSA-N
Synonyms
980-43-8
1(4(7(4acetylphenyl)1537dioxadiazocan3yl)phenyl)ethanone
11((1537dioxadiazocane37diyl)bis(41phenylene))diethanone
11(1537dioxadiazocane37diyldibenzene41diyl)diethanone
980438
CC(=O)C1=CC=C(C=C1)N2COCN(COC2)C3=CC=C(C=C3)C(=O)C
InChI=1SC20H22N2O4c115(23)173719(8417)2111251322(14261221)209518(61020)16(2)24h310H1114H212H3
MFCD00469176
ZINC000000858990
ZINC00858990
ZINC858990

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Available files

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