Vitas-M small molecule compound

2-(4-nitrophenyl)-2-oxoethyl 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)cyclohexanecarboxylate

Catalog ID
STK274605
SMILES O=C(C1CCC(CC1)N1C(=O)C2C(C1=O)C1CC2C=C1)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 C24H24N2O7 MW 452.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O7/c27-19(13-3-9-18(10-4-13)26(31)32)12-33-24(30)14-5-7-17(8-6-14)25-22(28)20-15-1-2-16(11-15)21(20)23(25)29/h1-4,9-10,14-17,20-21H,5-8,11-12H2
InChIKey
LNJQUUJUWUDILP-UHFFFAOYSA-N
Synonyms

2(4nitrophenyl)2oxoethyl4(13dioxo133a477ahexahydro2H47methanoisoindol2yl)cyclohexanecarboxylate
C1CC(CCC1C(=O)OCC(=O)C2=CC=C(C=C2)(N+)(=O)(O))N3C(=O)C4C5CC(C4C3=O)C=C5
InChI=1SC24H24N2O7c2719(133918(10413)26(31)32)123324(30)145717(8614)2522(28)20151216(1115)21(20)23(25)29h1491014172021H581112H2
MFCD02870867
O=C(C1CCC(CC1)N1C(=O)C2C(C1=O)C1CC2C=C1)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000100886256
ZINC000101875549

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Available files

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