Vitas-M small molecule compound
4-(quinoxalin-2-yl)benzyl 3-methyl-4-nitrobenzoate
Catalog ID
STK328256
SMILES O=C(c1ccc(c(c1)C)[N+](=O)[O-])OCc1ccc(cc1)c1cnc2c(n1)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 C23H17N3O4 MW 399.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O4/c1-15-12-18(10-11-22(15)26(28)29)23(27)30-14-16-6-8-17(9-7-16)21-13-24-19-4-2-3-5-20(19)25-21/h2-13H,14H2,1H3InChIKey
QHDGMFKZPGVAIT-UHFFFAOYSA-NSynonyms
704872-40-2(4QUINOXALIN2YLPHENYL)METHYL3METHYL4NITROBENZOATE
4(quinoxalin2yl)benzyl3methyl4nitrobenzoate
704872402
CC1=C(C=CC(=C1)C(=O)OCC2=CC=C(C=C2)C3=NC4=CC=CC=C4N=C3)(N+)(=O)(O)
InChI=1SC23H17N3O4c1151218(101122(15)26(28)29)23(27)3014166817(9716)21132419423520(19)2521h213H14H21H3
MFCD05857698
O=C(c1ccc(c(c1)C)(N+)(=O)(O))OCc1ccc(cc1)c1cnc2c(n1)cccc2
ZINC000001443281
ZINC01443281
ZINC1443281
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