Vitas-M small molecule compound
4-[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenoxy]benzonitrile
Catalog ID
STK369027
SMILES N#Cc1ccc(cc1)Oc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)[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 C21H11N3O5 MW 385.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11N3O5/c22-12-13-1-6-16(7-2-13)29-17-8-3-14(4-9-17)23-20(25)18-10-5-15(24(27)28)11-19(18)21(23)26/h1-11HInChIKey
JBQSQKCDUZSCQG-UHFFFAOYSA-NSynonyms
4(4(5nitro13dioxo13dihydro2Hisoindol2yl)phenoxy)benzonitrile
4(4(5NITRO13DIOXOBENZO(C)AZOLIDIN2YL)PHENOXY)BENZENECARBONITRILE
4(4(5NITRO13DIOXOISOINDOL2YL)PHENOXY)BENZONITRILE
C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)(N+)(=O)(O)
InChI=1SC21H11N3O5c2212131616(7213)29178314(4917)2320(25)1810515(24(27)28)1119(18)21(23)26h111H
MFCD00221792
N#Cc1ccc(cc1)Oc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)(N+)(=O)(O)
ZINC000000754586
ZINC00754586
ZINC754586
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