Vitas-M small molecule compound
methyl 4-{(3E)-1-[2-(2-hydroxyethoxy)ethyl]-3-[hydroxy(3-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-2-yl}benzoate
Catalog ID
STL054948
SMILES OCCOCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)[N+](=O)[O-])/O)/C1c1ccc(cc1)C(=O)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 C23H22N2O9 MW 470.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O9/c1-33-23(30)15-7-5-14(6-8-15)19-18(20(27)16-3-2-4-17(13-16)25(31)32)21(28)22(29)24(19)9-11-34-12-10-26/h2-8,13,19,26-27H,9-12H2,1H3/b20-18+InChIKey
ZBVHBKLYFFVHRP-CZIZESTLSA-NSynonyms
517890-39-0517890390
COC(=O)C1=CC=C(C=C1)C2C(=C(C3=CC(=CC=C3)(N+)(=O)(O))O)C(=O)C(=O)N2CCOCCO
InChI=1SC23H22N2O9c13323(30)157514(6815)1918(20(27)1632417(1316)25(31)32)21(28)22(29)24(19)91134121026h2813192627H912H21H3b2018+
methyl4((3E)1(2(2hydroxyethoxy)ethyl)3(hydroxy(3nitrophenyl)methylidene)45dioxopyrrolidin2yl)benzoate
MFCD05733104
OCCOCCN1C(=O)C(=O)C(=C(c2cccc(c2)(N+)(=O)(O))O)C1c1ccc(cc1)C(=O)OC
ZINC000102893677
ZINC000102893679
Check stock
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Check stock on Vitas-MAvailable files
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