Vitas-M small molecule compound
(E)-[1-(5-bromopyridinium-2-yl)-2-(2-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene](phenyl)methanolate
Catalog ID
STL147990
SMILES Brc1ccc([nH+]c1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/[O-])/C1c1ccccc1[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 C22H14BrN3O5 MW 480.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14BrN3O5/c23-14-10-11-17(24-12-14)25-19(15-8-4-5-9-16(15)26(30)31)18(21(28)22(25)29)20(27)13-6-2-1-3-7-13/h1-12,19,27H/b20-18+InChIKey
ZNOLICLNGBVYTO-CZIZESTLSA-NSynonyms
(4E)1(5BROMOPYRIDIN2YL)4(HYDROXY(PHENYL)METHYLIDENE)5(2NITROPHENYL)PYRROLIDINE23DIONE
(E)(1(5bromopyridinium2yl)2(2nitrophenyl)45dioxopyrrolidin3ylidene)(phenyl)methanolate
Brc1ccc((nH+)c1)N1C(=O)C(=O)C(=C(c2ccccc2)(O))C1c1ccccc1(N+)(=O)(O)
C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC=C(C=C3)Br)C4=CC=CC=C4(N+)(=O)(O))O
InChI=1SC22H14BrN3O5c2314101117(241214)2519(15845916(15)26(30)31)18(21(28)22(25)29)20(27)136213713h1121927Hb2018+
MFCD20755310
ZINC000101057216
ZINC000101057217
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