Vitas-M small molecule compound

2-(3-nitrophenyl)-2-oxoethyl (1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)acetate

Catalog ID
STK247251
SMILES O=C(CN1C(=O)C2C(C1=O)C1CC2CC1)OCC(=O)c1cccc(c1)[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 C19H18N2O7 MW 386.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O7/c22-14(10-2-1-3-13(7-10)21(26)27)9-28-15(23)8-20-18(24)16-11-4-5-12(6-11)17(16)19(20)25/h1-3,7,11-12,16-17H,4-6,8-9H2
InChIKey
TWJKYCDAQQTRKJ-UHFFFAOYSA-N
Synonyms

2(3NITROPHENYL)2OXOETHYL(13DIOXOOCTAHYDRO2H47METHANOISOINDOL2YL)ACETATE
C1CC2CC1C3C2C(=O)N(C3=O)CC(=O)OCC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC19H18N2O7c2214(1021313(710)21(26)27)92815(23)82018(24)16114512(611)17(16)19(20)25h13711121617H4689H2
MFCD01156408
O=C(CN1C(=O)C2C(C1=O)C1CC2CC1)OCC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000100534657
ZINC000101145951

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Available files

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