Vitas-M small molecule compound
ethyl 1-acetyl-7-(3-nitrophenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Catalog ID
STK549123
SMILES CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])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 C17H16N4O7 MW 388.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O7/c1-3-28-15(24)13-8-17(20(18-13)10(2)22)9-14(23)19(16(17)25)11-5-4-6-12(7-11)21(26)27/h4-7H,3,8-9H2,1-2H3InChIKey
DNGWYKVFZVOCCY-UHFFFAOYSA-NSynonyms
679799-50-9679799509
CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1cccc(c1)(N+)(=O)(O))C(=O)C
CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)C
ethyl1acetyl7(3nitrophenyl)68dioxo127triazaspiro(44)non2ene3carboxylate
ETHYL4ACETYL8(3NITROPHENYL)79DIOXO348TRIAZASPIRO(44)NON2ENE2CARBOXYLATE
InChI=1SC17H16N4O7c132815(24)13817(20(1813)10(2)22)914(23)19(16(17)25)1154612(711)21(26)27h47H389H212H3
MFCD03670487
ZINC000009045492
ZINC000009075391
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