Vitas-M small molecule compound

2-(azepan-1-yl)-N'-[(E)-(4-methoxy-3-nitrophenyl)methylidene]-2-oxoacetohydrazide

Catalog ID
STK539511
SMILES COc1ccc(cc1[N+](=O)[O-])/C=N/NC(=O)C(=O)N1CCCCCC1

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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 C16H20N4O5 MW 348.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O5/c1-25-14-7-6-12(10-13(14)20(23)24)11-17-18-15(21)16(22)19-8-4-2-3-5-9-19/h6-7,10-11H,2-5,8-9H2,1H3,(H,18,21)/b17-11+
InChIKey
CYFACVQBWAPVHZ-GZTJUZNOSA-N
Synonyms
351898-13-0
(E)2(azepan1yl)N(4methoxy3nitrobenzylidene)2oxoacetohydrazide
2(azepan1yl)N((E)(4methoxy3nitrophenyl)methylidene)2oxoacetohydrazide
2(AZEPAN1YL)N((E)(4METHOXY3NITROPHENYL)METHYLIDENEAMINO)2OXOACETAMIDE
351898130
COC1=C(C=C(C=C1)C=NNC(=O)C(=O)N2CCCCCC2)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C=NNC(=O)C(=O)N1CCCCCC1
InChI=1SC16H20N4O5c125147612(1013(14)20(23)24)11171815(21)16(22)1984235919h671011H2589H21H3(H1821)b1711+
MFCD01168161
ZINC000001815812
ZINC33344928

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Available files

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