Vitas-M small molecule compound
4-chloro-N-(2-methoxy-5-nitrophenyl)-3,5-dinitrobenzamide
Catalog ID
STK129038
SMILES COc1ccc(cc1NC(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])Cl)[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 C14H9ClN4O8 MW 396.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9ClN4O8/c1-27-12-3-2-8(17(21)22)6-9(12)16-14(20)7-4-10(18(23)24)13(15)11(5-7)19(25)26/h2-6H,1H3,(H,16,20)InChIKey
JMSPQKACFXPNNY-UHFFFAOYSA-NSynonyms
349088-96-6(4CHLORO35DINITROPHENYL)N(2METHOXY5NITROPHENYL)CARBOXAMIDE
349088966
4CHLORON(2METHOXY5NITROPHENYL)35DINITROBENZAMIDE
COC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)C2=CC(=C(C(=C2)(N+)(=O)(O))Cl)(N+)(=O)(O)
COc1ccc(cc1NC(=O)c1cc((N+)(=O)(O))c(c(c1)(N+)(=O)(O))Cl)(N+)(=O)(O)
InChI=1SC14H9ClN4O8c12712328(17(21)22)69(12)1614(20)7410(18(23)24)13(15)11(57)19(25)26h26H1H3(H1620)
MFCD02039295
ZINC000101571355
ZINC101571355
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