Vitas-M small molecule compound
2-(4-methyl-3-nitrophenyl)-2-oxoethyl 5-(cyclohexylamino)-5-oxopentanoate
Catalog ID
STK257875
SMILES O=C(OCC(=O)c1ccc(c(c1)[N+](=O)[O-])C)CCCC(=O)NC1CCCCC1
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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 C20H26N2O6 MW 390.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O6/c1-14-10-11-15(12-17(14)22(26)27)18(23)13-28-20(25)9-5-8-19(24)21-16-6-3-2-4-7-16/h10-12,16H,2-9,13H2,1H3,(H,21,24)InChIKey
ZWADSOCEUCGYDD-UHFFFAOYSA-NSynonyms
(2(4METHYL3NITROPHENYL)2OXOETHYL)5(CYCLOHEXYLAMINO)5OXOPENTANOATE
2(4methyl3nitrophenyl)2oxoethyl5(cyclohexylamino)5oxopentanoate
CC1=C(C=C(C=C1)C(=O)COC(=O)CCCC(=O)NC2CCCCC2)(N+)(=O)(O)
InChI=1SC20H26N2O6c114101115(1217(14)22(26)27)18(23)132820(25)95819(24)21166324716h101216H2913H21H3(H2124)
MFCD03186877
O=C(OCC(=O)c1ccc(c(c1)(N+)(=O)(O))C)CCCC(=O)NC1CCCCC1
ZINC000004845629
ZINC04845629
ZINC4845629
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