Vitas-M small molecule compound
3-(4-nitrobenzyl)-3-phenyl-1-benzofuran-2(3H)-one
Catalog ID
STL406252
SMILES [O-][N+](=O)c1ccc(cc1)CC1(c2ccccc2)C(=O)Oc2c1cccc2
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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 C21H15NO4 MW 345.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15NO4/c23-20-21(16-6-2-1-3-7-16,18-8-4-5-9-19(18)26-20)14-15-10-12-17(13-11-15)22(24)25/h1-13H,14H2InChIKey
HHFBVLSDPSXXSU-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)CC1(c2ccccc2)C(=O)Oc2c1cccc2
3((4NITROPHENYL)METHYL)3PHENYL1BENZOFURAN2ONE
3((4NITROPHENYL)METHYL)3PHENYL3HYDROBENZO(B)FURAN2ONE
3(4nitrobenzyl)3phenyl1benzofuran2(3H)one
C1=CC=C(C=C1)C2(C3=CC=CC=C3OC2=O)CC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H15NO4c232021(16621371618845919(18)2620)1415101217(131115)22(24)25h113H14H2
MFCD03158668
ZINC000000116091
ZINC000000116093
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