Vitas-M small molecule compound
methyl (4Z)-1-(3-chloro-4-methoxyphenyl)-2-methyl-4-(3-nitrobenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160474
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cccc(c1)[N+](=O)[O-])c1ccc(c(c1)Cl)OC
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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 C21H17ClN2O6 MW 428.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O6/c1-12-19(21(26)30-3)16(10-13-5-4-6-15(9-13)24(27)28)20(25)23(12)14-7-8-18(29-2)17(22)11-14/h4-11H,1-3H3/b16-10-InChIKey
HROTVLITXNAXOI-YBEGLDIGSA-NSynonyms
CC1=C(C(=CC2=CC(=CC=C2)(N+)(=O)(O))C(=O)N1C3=CC(=C(C=C3)OC)Cl)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1cccc(c1)(N+)(=O)(O))c1ccc(c(c1)Cl)OC
InChI=1SC21H17ClN2O6c11219(21(26)303)16(101354615(913)24(27)28)20(25)23(12)147818(292)17(22)1114h411H13H3b1610
METHYL(4Z)1(3CHLORO4METHOXYPHENYL)2METHYL4((3NITROPHENYL)METHYLIDENE)5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)1(3CHLORO4METHOXYPHENYL)2METHYL4(3NITROBENZYLIDENE)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03711853
ZINC000001163013
ZINC01163013
ZINC1163013
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