Vitas-M small molecule compound

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

Catalog ID
STK268408
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])COC(=O)C(N1C(=O)C2C(C1=O)C1CC2CC1)C(C)C

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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 C22H24N2O7 MW 428.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O7/c1-11(2)19(23-20(26)17-13-3-4-14(9-13)18(17)21(23)27)22(28)31-10-16(25)12-5-7-15(8-6-12)24(29)30/h5-8,11,13-14,17-19H,3-4,9-10H2,1-2H3
InChIKey
IPJWKCLBWAIBPY-UHFFFAOYSA-N
Synonyms

2(4nitrophenyl)2oxoethyl2(13dioxooctahydro2H47methanoisoindol2yl)3methylbutanoate
CC(C)C(C(=O)OCC(=O)C1=CC=C(C=C1)(N+)(=O)(O))N2C(=O)C3C4CCC(C4)C3C2=O
InChI=1SC22H24N2O7c111(2)19(2320(26)17133414(913)18(17)21(23)27)22(28)311016(25)125715(8612)24(29)30h581113141719H34910H212H3
MFCD01156399
O=C(c1ccc(cc1)(N+)(=O)(O))COC(=O)C(N1C(=O)C2C(C1=O)C1CC2CC1)C(C)C
ZINC000101145906
ZINC000245229935

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Available files

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