Vitas-M small molecule compound
(3E)-3-(4-nitrobenzylidene)-2,3-dihydro-4H-chromen-4-one
Catalog ID
STL191153
SMILES O=C1/C(=C/c2ccc(cc2)[N+](=O)[O-])/COc2c1cccc2
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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 C16H11NO4 MW 281.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11NO4/c18-16-12(10-21-15-4-2-1-3-14(15)16)9-11-5-7-13(8-6-11)17(19)20/h1-9H,10H2/b12-9+InChIKey
ZBDDYTVOLUGPBT-FMIVXFBMSA-NSynonyms
101001-06-3(3E)3((4NITROPHENYL)METHYLIDENE)CHROMEN4ONE
(3E)3(4nitrobenzylidene)23dihydro4Hchromen4one
(3E)3(4NITROBENZYLIDENE)CHROMAN4ONE
(Z)3(4nitrobenzylidene)chroman4one
101001063
3((E)(4NITROPHENYL)METHYLIDENE)23DIHYDRO4HCHROMEN4ONE
3(4NITROBENZYLIDENE)CHROMAN4ONE
4H1BENZOPYRAN4ONE23DIHYDRO3((4NITROPHENYL)METHYLENE)(3E)
C1C(=CC2=CC=C(C=C2)(N+)(=O)(O))C(=O)C3=CC=CC=C3O1
InChI=1SC16H11NO4c181612(102115421314(15)16)9115713(8611)17(19)20h19H10H2b129+
MFCD00491020
O=C1C(=Cc2ccc(cc2)(N+)(=O)(O))COc2c1cccc2
ZINC000000500363
ZINC00500363
ZINC500363
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