Vitas-M small molecule compound
[(3E)-3-[hydroxy(4-methylphenyl)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid
Catalog ID
STK596194
SMILES OC(=O)CN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1)[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 C20H16N2O7 MW 396.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O7/c1-11-2-4-13(5-3-11)18(25)16-17(12-6-8-14(9-7-12)22(28)29)21(10-15(23)24)20(27)19(16)26/h2-9,17,25H,10H2,1H3,(H,23,24)/b18-16+InChIKey
UHKSXECUZKIXPK-FBMGVBCBSA-NSynonyms
331751-66-7((3E)3(hydroxy(4methylphenyl)methylidene)2(4nitrophenyl)45dioxopyrrolidin1yl)aceticacid
2((3E)3(HYDROXY(4METHYLPHENYL)METHYLIDENE)2(4NITROPHENYL)45DIOXOPYRROLIDIN1YL)ACETICACID
331751667
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC(=O)O)C3=CC=C(C=C3)(N+)(=O)(O))O
InChI=1SC20H16N2O7c1112413(5311)18(25)1617(126814(9712)22(28)29)21(1015(23)24)20(27)19(16)26h291725H10H21H3(H2324)b1816+
MFCD07210402
OC(=O)CN1C(=O)C(=O)C(=C(c2ccc(cc2)C)O)C1c1ccc(cc1)(N+)(=O)(O)
ZINC000102619856
ZINC000102619863
Check stock
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