Vitas-M small molecule compound
2-amino-7-methyl-4-(4-nitrophenyl)-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Catalog ID
STK019093
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)oc(c2)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 C16H11N3O5 MW 325.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N3O5/c1-8-6-12-14(16(20)23-8)13(11(7-17)15(18)24-12)9-2-4-10(5-3-9)19(21)22/h2-6,13H,18H2,1H3InChIKey
SDXLGWQGANTHJH-UHFFFAOYSA-NSynonyms
220986-45-8220986458
2AMINO3CYANO4(4NITROPHENYL)7METHYL4H5HPYRANO(43B)PYRAN5ONE
2amino7methyl4(4nitrophenyl)5oxo45dihydropyrano(43b)pyran3carbonitrile
2AMINO7METHYL4(4NITROPHENYL)5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2AMINO7METHYL4(4NITROPHENYL)5OXO4HPYRANO(32C)PYRAN3CARBONITRILE
CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)(N+)(=O)(O))C(=O)O1
InChI=1SC16H11N3O5c1861214(16(20)238)13(11(717)15(18)2412)92410(539)19(21)22h2613H18H21H3
MFCD00544252
N#CC1=C(N)Oc2c(C1c1ccc(cc1)(N+)(=O)(O))c(=O)oc(c2)C
STK019093
ZINC000000281231
ZINC000000281232
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