Vitas-M small molecule compound

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

Catalog ID
STK843238
SMILES [O-][N+](=O)c1cccc(c1)c1c(=O)n(OCc2ccc(cc2)C(C)(C)C)c2c([n+]1[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 C25H23N3O5 MW 445.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O5/c1-25(2,3)19-13-11-17(12-14-19)16-33-27-22-10-5-4-9-21(22)26(30)23(24(27)29)18-7-6-8-20(15-18)28(31)32/h4-15H,16H2,1-3H3
InChIKey
OQRNEUVVWCYCPR-UHFFFAOYSA-N
Synonyms
370870-20-5
(O)(N+)(=O)c1cccc(c1)c1c(=O)n(OCc2ccc(cc2)C(C)(C)C)c2c((n+)1(O))cccc2
1((4tertbutylbenzyl)oxy)3(3nitrophenyl)quinoxalin2(1H)one4oxide
1((4TERTBUTYLPHENYL)METHOXY)3(3NITROPHENYL)4OXIDOQUINOXALIN4IUM2ONE
370870205
4((4(tertbutyl)benzyl)oxy)2(3nitrophenyl)3oxo34dihydroquinoxaline1oxide
4(4TERTBUTYLBENZYLOXY)2(3NITROPHENYL)3OXO34DIHYDROQUINOXALINE1OXIDE
CC(C)(C)C1=CC=C(C=C1)CON2C3=CC=CC=C3(N+)(=C(C2=O)C4=CC(=CC=C4)(N+)(=O)(O))(O)
InChI=1SC25H23N3O5c125(23)19131117(121419)163327221054921(22)26(30)23(24(27)29)1876820(1518)28(31)32h415H16H213H3
MFCD03010605
ZINC000002316091
ZINC02316091
ZINC2316091

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Available files

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