Vitas-M small molecule compound

(2Z)-6-hydroxy-2-(4-nitrobenzylidene)-1-benzofuran-3(2H)-one

Catalog ID
STK847278
SMILES Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)[N+](=O)[O-])/C2=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 C15H9NO5 MW 283.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H9NO5/c17-11-5-6-12-13(8-11)21-14(15(12)18)7-9-1-3-10(4-2-9)16(19)20/h1-8,17H/b14-7-
InChIKey
SJNIVFZEKRLLEP-AUWJEWJLSA-N
Synonyms
620545-96-2
(2Z)2((4NITROPHENYL)METHYLIDENE)6OXIDANYL1BENZOFURAN3ONE
(2Z)6HYDROXY2((4NITROPHENYL)METHYLENE)BENZOFURAN3ONE
(2Z)6HYDROXY2((4NITROPHENYL)METHYLIDENE)1BENZOFURAN3ONE
(2Z)6HYDROXY2((4NITROPHENYL)METHYLIDENE)3BENZOFURANONE
(2Z)6hydroxy2(4nitrobenzylidene)1benzofuran3(2H)one
(2Z)6HYDROXY2(4NITROBENZYLIDENE)COUMARAN3ONE
(Z)6hydroxy2(4nitrobenzylidene)benzofuran3(2H)one
620545962
6HYDROXY2((4NITROPHENYL)METHYLENE)BENZO(B)FURAN3ONE
6HYDROXY2(4(HYDROXY(OXIDO)AMINO)BENZYLIDENE)1BENZOFURAN3(2H)ONE
C1=CC(=CC=C1C=C2C(=O)C3=C(O2)C=C(C=C3)O)(N+)(=O)(O)
InChI=1SC15H9NO5c1711561213(811)2114(15(12)18)791310(429)16(19)20h1817Hb147
MFCD04161853
Oc1ccc2c(c1)OC(=Cc1ccc(cc1)(N+)(=O)(O))C2=O
ZINC000000536677
ZINC00536677
ZINC536677

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.