Vitas-M small molecule compound

(2Z)-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl morpholine-4-carboxylate

Catalog ID
STK923623
SMILES O=C(N1CCOCC1)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)[N+](=O)[O-])/C2=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 C20H16N2O7 MW 396.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O7/c23-19-16-5-4-15(28-20(24)21-6-8-27-9-7-21)12-17(16)29-18(19)11-13-2-1-3-14(10-13)22(25)26/h1-5,10-12H,6-9H2/b18-11-
InChIKey
ZBQCLSKQCLSIIG-WQRHYEAKSA-N
Synonyms
672914-54-4
((2Z)2((3NITROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)MORPHOLINE4CARBOXYLATE
(2Z)2(3nitrobenzylidene)3oxo23dihydro1benzofuran6ylmorpholine4carboxylate
(Z)2(3nitrobenzylidene)3oxo23dihydrobenzofuran6ylmorpholine4carboxylate
2((3NITROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLMORPHOLINE4CARBOXYLATE
672914544
C1COCCN1C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))O3
InChI=1SC20H16N2O7c2319165415(2820(24)2168279721)1217(16)2918(19)111321314(1013)22(25)26h151012H69H2b1811
MFCD04075645
O=C(N1CCOCC1)Oc1ccc2c(c1)OC(=Cc1cccc(c1)(N+)(=O)(O))C2=O
ZINC000005219521
ZINC05219521
ZINC5219521

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Available files

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