Vitas-M small molecule compound

4-acetyl-3,3-dimethyl-1-(4-nitrobenzyl)-3,4-dihydroquinoxalin-2(1H)-one

Catalog ID
STK874326
SMILES CC(=O)N1c2ccccc2N(C(=O)C1(C)C)Cc1ccc(cc1)[N+](=O)[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 C19H19N3O4 MW 353.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O4/c1-13(23)21-17-7-5-4-6-16(17)20(18(24)19(21,2)3)12-14-8-10-15(11-9-14)22(25)26/h4-11H,12H2,1-3H3
InChIKey
UOLNTFMCZNRZKJ-UHFFFAOYSA-N
Synonyms

4ACETYL33DIMETHYL1((4NITROPHENYL)METHYL)QUINOXALIN2ONE
4ACETYL33DIMETHYL1(4NITROBENZYL)34DIHYDRO2(1H)QUINOXALINONE
4acetyl33dimethyl1(4nitrobenzyl)34dihydroquinoxalin2(1H)one
CC(=O)N1C2=CC=CC=C2N(C(=O)C1(C)C)CC3=CC=C(C=C3)(N+)(=O)(O)
CC(=O)N1c2ccccc2N(C(=O)C1(C)C)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H19N3O4c113(23)2117754616(17)20(18(24)19(212)3)121481015(11914)22(25)26h411H12H213H3
MFCD02214489
ZINC000004812700
ZINC04812700
ZINC4812700

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Available files

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