Vitas-M small molecule compound

ethyl 3-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoyl]amino}-3-(3-nitrophenyl)propanoate

Catalog ID
STK768399
SMILES CCOC(=O)CC(c1cccc(c1)[N+](=O)[O-])NC(=O)CCCCCN1C(=O)c2c(C1=O)cccc2

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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 C25H27N3O7 MW 481.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O7/c1-2-35-23(30)16-21(17-9-8-10-18(15-17)28(33)34)26-22(29)13-4-3-7-14-27-24(31)19-11-5-6-12-20(19)25(27)32/h5-6,8-12,15,21H,2-4,7,13-14,16H2,1H3,(H,26,29)
InChIKey
DFNOZVJJZMWLGS-UHFFFAOYSA-N
Synonyms

CCOC(=O)CC(C1=CC(=CC=C1)(N+)(=O)(O))NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O
CCOC(=O)CC(c1cccc(c1)(N+)(=O)(O))NC(=O)CCCCCN1C(=O)c2c(C1=O)cccc2
ethyl3((6(13dioxo13dihydro2Hisoindol2yl)hexanoyl)amino)3(3nitrophenyl)propanoate
ETHYL3(6(13DIOXOBENZO(C)AZOLIN2YL)HEXANOYLAMINO)3(3NITROPHENYL)PROPANOATE
ETHYL3(6(13DIOXOISOINDOL2YL)HEXANOYLAMINO)3(3NITROPHENYL)PROPANOATE
InChI=1SC25H27N3O7c123523(30)1621(17981018(1517)28(33)34)2622(29)13437142724(31)1911561220(19)25(27)32h568121521H247131416H21H3(H2629)
MFCD03133536
ZINC000008856146
ZINC000008955614

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Available files

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