Vitas-M small molecule compound

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

Catalog ID
STK552206
SMILES O=c1n(OCc2ccc(cc2)C(C)(C)C)c2ccccc2[n+](c1c1ccc2c(c1)cccc2)[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 C29H26N2O3 MW 450.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O3/c1-29(2,3)24-16-12-20(13-17-24)19-34-31-26-11-7-6-10-25(26)30(33)27(28(31)32)23-15-14-21-8-4-5-9-22(21)18-23/h4-18H,19H2,1-3H3
InChIKey
NEXULTXKNLKIFF-UHFFFAOYSA-N
Synonyms
799802-87-2
1((4tertbutylbenzyl)oxy)3(naphthalen2yl)quinoxalin2(1H)one4oxide
1((4TERTBUTYLPHENYL)METHOXY)3NAPHTHALEN2YL4OXIDOQUINOXALIN4IUM2ONE
4((4(tertbutyl)benzyl)oxy)2(naphthalen2yl)3oxo34dihydroquinoxaline1oxide
799802872
CC(C)(C)C1=CC=C(C=C1)CON2C3=CC=CC=C3(N+)(=C(C2=O)C4=CC5=CC=CC=C5C=C4)(O)
InChI=1SC29H26N2O3c129(23)24161220(131724)1934312611761025(26)30(33)27(28(31)32)23151421845922(21)1823h418H19H213H3
MFCD03678999
O=c1n(OCc2ccc(cc2)C(C)(C)C)c2ccccc2(n+)(c1c1ccc2c(c1)cccc2)(O)
ZINC000002225069
ZINC02225069
ZINC2225069

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Available files

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