Vitas-M small molecule compound

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

Catalog ID
STK247406
SMILES O=C(c1ccc2c(c1)C(=O)N(C2=O)c1cccc2c1cccc2)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 C27H16N2O7 MW 480.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H16N2O7/c30-24(17-8-11-19(12-9-17)29(34)35)15-36-27(33)18-10-13-21-22(14-18)26(32)28(25(21)31)23-7-3-5-16-4-1-2-6-20(16)23/h1-14H,15H2
InChIKey
SYEYDWRRCXLELM-UHFFFAOYSA-N
Synonyms

(2(4NITROPHENYL)2OXOETHYL)2NAPHTHALEN1YL13DIOXOISOINDOLE5CARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(1NAPHTHYL)13DIOXO5ISOINDOLINECARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(NAPHTHALEN1YL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2NAPHTHYL13DIOXOBENZO(C)AZOLIDINE5CARBOXYLATE
C1=CC=C2C(=C1)C=CC=C2N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)OCC(=O)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC27H16N2O7c3024(1781119(12917)29(34)35)153627(33)1810132122(1418)26(32)28(25(21)31)2373516412620(16)23h114H15H2
MFCD01138218
O=C(c1ccc2c(c1)C(=O)N(C2=O)c1cccc2c1cccc2)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000004157295
ZINC04157295
ZINC4157295

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Available files

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