Vitas-M small molecule compound

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

Catalog ID
STK247350
SMILES Cc1cccc(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 C24H16N2O7 MW 444.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16N2O7/c1-14-3-2-4-18(11-14)25-22(28)19-10-7-16(12-20(19)23(25)29)24(30)33-13-21(27)15-5-8-17(9-6-15)26(31)32/h2-12H,13H2,1H3
InChIKey
ROJGOTFYFSUOQH-UHFFFAOYSA-N
Synonyms

(2(4NITROPHENYL)2OXOETHYL)2(3METHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(3METHYLPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(3METHYLPHENYL)13DIOXO5ISOINDOLINECARBOXYLATE
2(4NITROPHENYL)2OXOETHYL2(3METHYLPHENYL)13DIOXOBENZO(C)AZOLIDINE5CARBOXYLATE
CC1=CC(=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
Cc1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H16N2O7c11432418(1114)2522(28)1910716(1220(19)23(25)29)24(30)331321(27)155817(9615)26(31)32h212H13H21H3
MFCD01138197
ZINC000000990443
ZINC00990443
ZINC990443

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Available files

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