Vitas-M small molecule compound
2-(4-methyl-3-nitrophenyl)-2-oxoethyl diphenylacetate
Catalog ID
STL169057
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])C)COC(=O)C(c1ccccc1)c1ccccc1
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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 C23H19NO5 MW 389.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19NO5/c1-16-12-13-19(14-20(16)24(27)28)21(25)15-29-23(26)22(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,22H,15H2,1H3InChIKey
WISMLHAZUUNLPR-UHFFFAOYSA-NSynonyms
(2(4METHYL3NITROPHENYL)2OXOETHYL)22DIPHENYLACETATE
2(3NITRO4METHYLPHENYL)2OXOETHYLDIPHENYLACETATE
2(4METHYL3NITROPHENYL)2OXOETHYL22DIPHENYLACETATE
2(4methyl3nitrophenyl)2oxoethyldiphenylacetate
CC1=C(C=C(C=C1)C(=O)COC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)(N+)(=O)(O)
InChI=1SC23H19NO5c116121319(1420(16)24(27)28)21(25)152923(26)22(178425917)18106371118h21422H15H21H3
MFCD02174291
O=C(c1ccc(c(c1)(N+)(=O)(O))C)COC(=O)C(c1ccccc1)c1ccccc1
ZINC000000671685
ZINC00671685
ZINC671685
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