Vitas-M small molecule compound
(4E)-4-[hydroxy(4-methylphenyl)methylidene]-1-(3-methoxypropyl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Catalog ID
STL148403
SMILES COCCCN1C(=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 C22H22N2O6 MW 410.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O6/c1-14-4-6-16(7-5-14)20(25)18-19(15-8-10-17(11-9-15)24(28)29)23(12-3-13-30-2)22(27)21(18)26/h4-11,19,25H,3,12-13H2,1-2H3/b20-18+InChIKey
ARBSCXNVWJZPKW-CZIZESTLSA-NSynonyms
(4E)4(hydroxy(4methylphenyl)methylidene)1(3methoxypropyl)5(4nitrophenyl)pyrrolidine23dione
3HYDROXY1(3METHOXYPROPYL)4((4METHYLPHENYL)CARBONYL)5(4NITROPHENYL)25DIHYDRO1HPYRROL2ONE
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCOC)C3=CC=C(C=C3)(N+)(=O)(O))O
COCCCN1C(=O)C(=O)C(=C(c2ccc(cc2)C)O)C1c1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H22N2O6c1144616(7514)20(25)1819(1581017(11915)24(28)29)23(12313302)22(27)21(18)26h4111925H31213H212H3b2018+
MFCD03815351
ZINC000102928300
ZINC000102928301
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