Vitas-M small molecule compound

diethyl 4,4'-[(1,9-dioxononane-1,9-diyl)diimino]dibenzoate

Catalog ID
STK073363
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CCCCCCCC(=O)Nc1ccc(cc1)C(=O)OCC

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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 C27H34N2O6 MW 482.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O6/c1-3-34-26(32)20-12-16-22(17-13-20)28-24(30)10-8-6-5-7-9-11-25(31)29-23-18-14-21(15-19-23)27(33)35-4-2/h12-19H,3-11H2,1-2H3,(H,28,30)(H,29,31)
InChIKey
JPGKPBSRRNVWPM-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCCCCCC(=O)NC2=CC=C(C=C2)C(=O)OCC
CCOC(=O)c1ccc(cc1)NC(=O)CCCCCCCC(=O)Nc1ccc(cc1)C(=O)OCC
DIETHYL44((19DIOXO19NONANEDIYL)DI(IMINO))DIBENZOATE
DIETHYL44((19DIOXONONANE19DIYL)DIIMINO)DIBENZOATE
ETHYL4((9(4(ETHOXYCARBONYL)ANILINO)9OXONONANOYL)AMINO)BENZOATE
ETHYL4((9(4ETHOXYCARBONYLANILINO)9OXONONANOYL)AMINO)BENZOATE
InChI=1SC27H34N2O6c133426(32)20121622(171320)2824(30)10865791125(31)2923181421(151923)27(33)3542h1219H311H212H3(H2830)(H2931)
MFCD01630596
STK073363
ZINC000008398246
ZINC08398246
ZINC8398246

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Available files

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