Vitas-M small molecule compound

{4-[5-(3-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]phenoxy}acetic acid

Catalog ID
STK054530
SMILES OC(=O)COc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)Oc1cccc(c1)[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 C22H14N2O8 MW 434.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N2O8/c25-20(26)12-31-15-6-4-13(5-7-15)23-21(27)18-9-8-17(11-19(18)22(23)28)32-16-3-1-2-14(10-16)24(29)30/h1-11H,12H2,(H,25,26)
InChIKey
XVOFSSVDBVXAGX-UHFFFAOYSA-N
Synonyms

(4(5(3NITROPHENOXY)13DIOXO13DIHYDRO2HISOINDOL2YL)PHENOXY)ACETICACID
2(4(5(3NITROPHENOXY)13DIOXOISOINDOL2YL)PHENOXY)ACETICACID
2(4(5(3nitrophenoxy)13dioxoisoindolin2yl)phenoxy)aceticacid
C1=CC(=CC(=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)OCC(=O)O)(N+)(=O)(O)
InChI=1SC22H14N2O8c2520(26)1231156413(5715)2321(27)189817(1119(18)22(23)28)321631214(1016)24(29)30h111H12H2(H2526)
MFCD01974297
OC(=O)COc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)Oc1cccc(c1)(N+)(=O)(O)
STK054530
ZINC000009309969
ZINC9309969

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Available files

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