Vitas-M small molecule compound
[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(2-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]acetic acid
Catalog ID
STK577197
SMILES OC(=O)CN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/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 C19H13N3O9 MW 427.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N3O9/c23-14(24)9-20-16(12-3-1-2-4-13(12)22(30)31)15(18(26)19(20)27)17(25)10-5-7-11(8-6-10)21(28)29/h1-8,16,25H,9H2,(H,23,24)/b17-15+InChIKey
GERHWCJSZRVCRO-BMRADRMJSA-NSynonyms
((3E)3(hydroxy(4nitrophenyl)methylidene)2(2nitrophenyl)45dioxopyrrolidin1yl)aceticacid
2((3E)3(HYDROXY(4NITROPHENYL)METHYLIDENE)2(2NITROPHENYL)45DIOXOPYRROLIDIN1YL)ACETICACID
C1=CC=C(C(=C1)C2C(=C(C3=CC=C(C=C3)(N+)(=O)(O))O)C(=O)C(=O)N2CC(=O)O)(N+)(=O)(O)
InChI=1SC19H13N3O9c2314(24)92016(12312413(12)22(30)31)15(18(26)19(20)27)17(25)105711(8610)21(28)29h181625H9H2(H2324)b1715+
MFCD07208621
OC(=O)CN1C(=O)C(=O)C(=C(c2ccc(cc2)(N+)(=O)(O))O)C1c1ccccc1(N+)(=O)(O)
ZINC000009013198
ZINC000009014717
Check stock
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Check stock on Vitas-MAvailable files
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