Vitas-M small molecule compound

1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide

Catalog ID
STK545671
SMILES COc1ccc(cc1)c1[n+]([O-])c2ccccc2n(c1=O)OCc1ccc(cc1)C(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 C26H26N2O4 MW 430.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O4/c1-26(2,3)20-13-9-18(10-14-20)17-32-28-23-8-6-5-7-22(23)27(30)24(25(28)29)19-11-15-21(31-4)16-12-19/h5-16H,17H2,1-4H3
InChIKey
NFVRPAFARGTNHY-UHFFFAOYSA-N
Synonyms
797797-72-9
1((4tertbutylbenzyl)oxy)3(4methoxyphenyl)quinoxalin2(1H)one4oxide
1((4TERTBUTYLPHENYL)METHOXY)3(4METHOXYPHENYL)4OXIDOQUINOXALIN4IUM2ONE
4((4(tertbutyl)benzyl)oxy)2(4methoxyphenyl)3oxo34dihydroquinoxaline1oxide
797797729
CC(C)(C)C1=CC=C(C=C1)CON2C3=CC=CC=C3(N+)(=C(C2=O)C4=CC=C(C=C4)OC)(O)
COc1ccc(cc1)c1(n+)((O))c2ccccc2n(c1=O)OCc1ccc(cc1)C(C)(C)C
InChI=1SC26H26N2O4c126(23)2013918(101420)17322823865722(23)27(30)24(25(28)29)19111521(314)161219h516H17H214H3
MFCD03667781
ZINC000002195250
ZINC2195250

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Available files

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