Vitas-M small molecule compound

7-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)oxy]-2H-chromen-2-one

Catalog ID
STK773854
SMILES O=c1ccc2c(o1)cc(cc2)Oc1nc(nn1C)[N+](=O)[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 C12H8N4O5 MW 288.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H8N4O5/c1-15-12(13-11(14-15)16(18)19)20-8-4-2-7-3-5-10(17)21-9(7)6-8/h2-6H,1H3
InChIKey
DYAKISXVUGXZQO-UHFFFAOYSA-N
Synonyms
695201-86-6
695201866
7((1methyl3nitro1H124triazol5yl)oxy)2Hchromen2one
7((2METHYL5NITRO124TRIAZOL3YL)OXY)CHROMEN2ONE
7(1METHYL3NITRO124TRIAZOL5YLOXY)CHROMEN2ONE
7(2METHYL5NITRO2H(124)TRIAZOL3YLOXY)CHROMEN2ONE
CN1C(=NC(=N1)(N+)(=O)(O))OC2=CC3=C(C=C2)C=CC(=O)O3
InChI=1SC12H8N4O5c11512(1311(1415)16(18)19)2084273510(17)219(7)68h26H1H3
MFCD03855750
O=c1ccc2c(o1)cc(cc2)Oc1nc(nn1C)(N+)(=O)(O)
ZINC000000111880
ZINC00111880
ZINC111880

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Available files

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