Vitas-M small molecule compound
(E)-(3,4-dimethoxyphenyl){1-[3-(dimethylammonio)propyl]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL043401
SMILES COc1ccc(cc1OC)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])CCC[NH+](C)C)/[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 C24H27N3O7 MW 469.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O7/c1-25(2)12-5-13-26-21(15-6-9-17(10-7-15)27(31)32)20(23(29)24(26)30)22(28)16-8-11-18(33-3)19(14-16)34-4/h6-11,14,21,28H,5,12-13H2,1-4H3/b22-20+InChIKey
VULCMNAPGRCBIZ-LSDHQDQOSA-NSynonyms
615276-51-2(4E)4((34DIMETHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5(4NITROPHENYL)PYRROLIDINE23DIONE
(E)(34dimethoxyphenyl)(1(3(dimethylammonio)propyl)2(4nitrophenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(34DIMETHOXYPHENYL)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(4NITROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
615276512
CN(C)CCCN1C(C(=C(C2=CC(=C(C=C2)OC)OC)O)C(=O)C1=O)C3=CC=C(C=C3)(N+)(=O)(O)
COc1ccc(cc1OC)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)(N+)(=O)(O))CCC(NH+)(C)C)(O)
InChI=1SC24H27N3O7c125(2)125132621(156917(10715)27(31)32)20(23(29)24(26)30)22(28)1681118(333)19(1416)344h611142128H51213H214H3b2220+
MFCD18248205
ZINC000009270275
ZINC000009270488
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.