Vitas-M small molecule compound

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

Catalog ID
STK247107
SMILES Clc1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)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 C23H13ClN2O7 MW 464.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13ClN2O7/c24-15-2-1-3-17(11-15)25-21(28)18-9-6-14(10-19(18)22(25)29)23(30)33-12-20(27)13-4-7-16(8-5-13)26(31)32/h1-11H,12H2
InChIKey
OWVQCEOHYXPGDY-UHFFFAOYSA-N
Synonyms

(2(4NITROPHENYL)2OXOETHYL)2(3CHLOROPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(3CHLOROPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(3CHLOROPHENYL)13DIOXO5ISOINDOLINECARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(3CHLOROPHENYL)13DIOXOBENZO(C)AZOLIDINE5CARBOXYLATE
C1=CC(=CC(=C1)Cl)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
Clc1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC23H13ClN2O7c241521317(1115)2521(28)189614(1019(18)22(25)29)23(30)331220(27)134716(8513)26(31)32h111H12H2
MFCD01138216
ZINC000000990446
ZINC00990446
ZINC990446

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Available files

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