Vitas-M small molecule compound
(3Z)-3-[(4-ethylphenyl)(nitro)methylidene]-2-benzofuran-1(3H)-one
Catalog ID
STK870711
SMILES CCc1ccc(cc1)/C(=C\1/OC(=O)c2c1cccc2)/[N+](=O)[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 C17H13NO4 MW 295.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13NO4/c1-2-11-7-9-12(10-8-11)15(18(20)21)16-13-5-3-4-6-14(13)17(19)22-16/h3-10H,2H2,1H3/b16-15-InChIKey
NPJGYLGVDIXMDJ-NXVVXOECSA-NSynonyms
30516-61-1(3Z)3((4ethylphenyl)(nitro)methylidene)2benzofuran1(3H)one
(3Z)3((4ETHYLPHENYL)NITROMETHYLIDENE)2BENZOFURAN1ONE
(Z)3((4ethylphenyl)(nitro)methylene)isobenzofuran1(3H)one
30516611
CCC1=CC=C(C=C1)C(=C2C3=CC=CC=C3C(=O)O2)(N+)(=O)(O)
CCc1ccc(cc1)C(=C1OC(=O)c2c1cccc2)(N+)(=O)(O)
InChI=1SC17H13NO4c12117912(10811)15(18(20)21)1613534614(13)17(19)2216h310H2H21H3b1615
MFCD00604549
ZINC000000295869
ZINC00295869
ZINC295869
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