Vitas-M small molecule compound
(E)-(4-methoxyphenyl){1-[2-(morpholin-4-ium-4-yl)ethyl]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK566539
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])CC[NH+]1CCOCC1)/[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 C24H25N3O7 MW 467.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O7/c1-33-19-8-4-17(5-9-19)22(28)20-21(16-2-6-18(7-3-16)27(31)32)26(24(30)23(20)29)11-10-25-12-14-34-15-13-25/h2-9,21,28H,10-15H2,1H3/b22-20+InChIKey
SHTGIWOOTPTZGJ-LSDHQDQOSA-NSynonyms
496774-51-7(4E)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5(4NITROPHENYL)PYRROLIDINE23DIONE
(E)(4methoxyphenyl)(1(2(morpholin4ium4yl)ethyl)2(4nitrophenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4METHOXYPHENYL)(1(2MORPHOLIN4IUM4YLETHYL)2(4NITROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
496774517
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC=C(C=C4)(N+)(=O)(O))O
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)(N+)(=O)(O))CC(NH+)1CCOCC1)(O)
InChI=1SC24H25N3O7c133198417(5919)22(28)2021(162618(7316)27(31)32)26(24(30)23(20)29)111025121434151325h292128H1015H21H3b2220+
MFCD18245053
ZINC000102542480
ZINC000102542485
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.