Vitas-M small molecule compound

(4E)-4-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-1-(2-methoxyethyl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione

Catalog ID
STL047251
SMILES COCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2C)OC)/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 C22H22N2O7 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O7/c1-13-12-16(31-3)8-9-17(13)20(25)18-19(14-4-6-15(7-5-14)24(28)29)23(10-11-30-2)22(27)21(18)26/h4-9,12,19,25H,10-11H2,1-3H3/b20-18+
InChIKey
JJSFATASBRUFCQ-CZIZESTLSA-N
Synonyms
499209-33-5
(4E)4(hydroxy(4methoxy2methylphenyl)methylidene)1(2methoxyethyl)5(4nitrophenyl)pyrrolidine23dione
3HYDROXY1(2METHOXYETHYL)4((4METHOXY2METHYLPHENYL)CARBONYL)5(4NITROPHENYL)3PYRROLIN2ONE
3HYDROXY4((4METHOXY2METHYLPHENYL)CARBONYL)1(2METHOXYETHYL)5(4NITROPHENYL)25DIHYDRO1HPYRROL2ONE
499209335
CC1=C(C=CC(=C1)OC)C(=C2C(N(C(=O)C2=O)CCOC)C3=CC=C(C=C3)(N+)(=O)(O))O
COCCN1C(=O)C(=O)C(=C(c2ccc(cc2C)OC)O)C1c1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H22N2O7c1131216(313)8917(13)20(25)1819(144615(7514)24(28)29)23(1011302)22(27)21(18)26h49121925H1011H213H3b2018+
MFCD03801336
ZINC000102883038
ZINC000102883040

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Available files

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