Vitas-M small molecule compound
(4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(2-methoxyethyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Catalog ID
STL045065
SMILES COCCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)OCC)\O)/C(=O)C1=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 C22H22N2O7 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O7/c1-3-31-17-9-7-14(8-10-17)20(25)18-19(15-5-4-6-16(13-15)24(28)29)23(11-12-30-2)22(27)21(18)26/h4-10,13,19,25H,3,11-12H2,1-2H3/b20-18+InChIKey
JFOFLQVMKQPGCO-CZIZESTLSA-NSynonyms
385416-90-0(4E)4((4ethoxyphenyl)(hydroxy)methylidene)1(2methoxyethyl)5(3nitrophenyl)pyrrolidine23dione
(4E)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(2METHOXYETHYL)5(3NITROPHENYL)PYRROLIDINE23DIONE
385416900
4((4ETHOXYPHENYL)CARBONYL)3HYDROXY1(2METHOXYETHYL)5(3NITROPHENYL)25DIHYDRO1HPYRROL2ONE
4((4ETHOXYPHENYL)CARBONYL)3HYDROXY1(2METHOXYETHYL)5(3NITROPHENYL)3PYRROLIN2ONE
CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCOC)C3=CC(=CC=C3)(N+)(=O)(O))O
COCCN1C(c2cccc(c2)(N+)(=O)(O))C(=C(c2ccc(cc2)OCC)O)C(=O)C1=O
InChI=1SC22H22N2O7c1331179714(81017)20(25)1819(1554616(1315)24(28)29)23(1112302)22(27)21(18)26h410131925H31112H212H3b2018+
MFCD03800667
ZINC000102876320
ZINC000102876323
Check stock
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Check stock on Vitas-MAvailable files
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