Vitas-M small molecule compound

2-(4-nitrophenyl)-2-oxoethyl 2-(2,3-dichlorophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK247496
SMILES O=C(c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1Cl)Cl)OCC(=O)c1ccc(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 C23H12Cl2N2O7 MW 499.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H12Cl2N2O7/c24-17-2-1-3-18(20(17)25)26-21(29)15-9-6-13(10-16(15)22(26)30)23(31)34-11-19(28)12-4-7-14(8-5-12)27(32)33/h1-10H,11H2
InChIKey
YZEBSWMPBSGRPO-UHFFFAOYSA-N
Synonyms

(2(4NITROPHENYL)2OXOETHYL)2(23DICHLOROPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(23DICHLOROPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(23DICHLOROPHENYL)13DIOXO5ISOINDOLINECARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(23DICHLOROPHENYL)13DIOXOBENZO(C)AZOLIDINE5CARBOXYLATE
C1=CC(=C(C(=C1)Cl)Cl)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC23H12Cl2N2O7c241721318(20(17)25)2621(29)159613(1016(15)22(26)30)23(31)341119(28)124714(8512)27(32)33h110H11H2
MFCD01138182
O=C(c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1Cl)Cl)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000000990439
ZINC00990439
ZINC990439

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.