Vitas-M small molecule compound

4-nitrophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate

Catalog ID
STK253777
SMILES O=C(c1ccc(cc1)N1C(=O)c2c(C1=O)cccc2)Oc1ccc(cc1)[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 C21H12N2O6 MW 388.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12N2O6/c24-19-17-3-1-2-4-18(17)20(25)22(19)14-7-5-13(6-8-14)21(26)29-16-11-9-15(10-12-16)23(27)28/h1-12H
InChIKey
DBBRTYYMYFNYMF-UHFFFAOYSA-N
Synonyms

(4NITROPHENYL)4(13DIOXOISOINDOL2YL)BENZOATE
4nitrophenyl4(13dioxo13dihydro2Hisoindol2yl)benzoate
4NITROPHENYL4(13DIOXOBENZO(C)AZOLIDIN2YL)BENZOATE
C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H12N2O6c241917312418(17)20(25)22(19)147513(6814)21(26)291611915(101216)23(27)28h112H
MFCD00786114
O=C(c1ccc(cc1)N1C(=O)c2c(C1=O)cccc2)Oc1ccc(cc1)(N+)(=O)(O)
ZINC000004108779
ZINC04108779
ZINC4108779

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Available files

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