Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(4-methoxyphenyl)methanolate
Catalog ID
STK560721
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CCC[NH+](CC)CC)/[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 C25H30N2O4 MW 422.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O4/c1-4-26(5-2)16-9-17-27-22(18-10-7-6-8-11-18)21(24(29)25(27)30)23(28)19-12-14-20(31-3)15-13-19/h6-8,10-15,22,28H,4-5,9,16-17H2,1-3H3/b23-21+InChIKey
WMGULXIGISFJIA-XTQSDGFTSA-NSynonyms
615271-69-7(4E)1(3(DIETHYLAMINO)PROPYL)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)5PHENYLPYRROLIDINE23DIONE
(E)(1(3(diethylammonio)propyl)45dioxo2phenylpyrrolidin3ylidene)(4methoxyphenyl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)45DIOXO2PHENYLPYRROLIDIN3YLIDENE)(4METHOXYPHENYL)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)3HYDROXY4((4METHOXYPHENYL)CARBONYL)5PHENYL3PYRROLIN2ONE
615271697
CCN(CC)CCCN1C(C(=C(C2=CC=C(C=C2)OC)O)C(=O)C1=O)C3=CC=CC=C3
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccccc1)CCC(NH+)(CC)CC)(O)
InChI=1SC25H30N2O4c1426(52)169172722(18107681118)21(24(29)25(27)30)23(28)19121420(313)151319h6810152228H4591617H213H3b2321+
MFCD18243616
ZINC000102498431
ZINC000102498437
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.