Vitas-M small molecule compound

2-(4-nitrophenyl)-2-oxoethyl 4-(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)cyclohexanecarboxylate

Catalog ID
STK359385
SMILES O=C(C1CCC(CC1)N1C(=O)c2c(C1=O)cc(c(c2)Cl)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 C23H18Cl2N2O7 MW 505.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18Cl2N2O7/c24-18-9-16-17(10-19(18)25)22(30)26(21(16)29)14-5-3-13(4-6-14)23(31)34-11-20(28)12-1-7-15(8-2-12)27(32)33/h1-2,7-10,13-14H,3-6,11H2
InChIKey
XAXACULRIJSEAR-UHFFFAOYSA-N
Synonyms

(2(4NITROPHENYL)2OXOETHYL)4(56DICHLORO13DIOXOISOINDOL2YL)CYCLOHEXANE1CARBOXYLATE
2(4nitrophenyl)2oxoethyl4(56dichloro13dioxo13dihydro2Hisoindol2yl)cyclohexanecarboxylate
2(4NITROPHENYL)2OXOETHYL4(56DICHLORO13DIOXOBENZO(C)AZOLIN2YL)CYCLOHEXANECARBOXYLATE
C1CC(CCC1C(=O)OCC(=O)C2=CC=C(C=C2)(N+)(=O)(O))N3C(=O)C4=CC(=C(C=C4C3=O)Cl)Cl
InChI=1SC23H18Cl2N2O7c241891617(1019(18)25)22(30)26(21(16)29)145313(4614)23(31)341120(28)121715(8212)27(32)33h127101314H3611H2
MFCD02915350
O=C(C1CCC(CC1)N1C(=O)c2c(C1=O)cc(c(c2)Cl)Cl)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000008722280
ZINC08722280
ZINC8722280

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Available files

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