Vitas-M small molecule compound
(3E)-3-[(2-methylphenyl)(nitro)methylidene]-2-benzofuran-1(3H)-one
Catalog ID
STK870775
SMILES [O-][N+](=O)/C(=C\1/OC(=O)c2c1cccc2)/c1ccccc1C
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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/c1-10-6-2-3-7-11(10)14(17(19)20)15-12-8-4-5-9-13(12)16(18)21-15/h2-9H,1H3/b15-14+InChIKey
XMQQFVQARVCDCQ-CCEZHUSRSA-NSynonyms
304446-20-6(3E)3((2methylphenyl)(nitro)methylidene)2benzofuran1(3H)one
(3E)3((2METHYLPHENYL)NITROMETHYLIDENE)2BENZOFURAN1ONE
(E)3(nitro(otolyl)methylene)isobenzofuran1(3H)one
(O)(N+)(=O)C(=C1OC(=O)c2c1cccc2)c1ccccc1C
3((2METHYLPHENYL)NITROMETHYLENE)ISOBENZOFURAN1ONE
3(NITROOTOLYLMETHYLENE)3HISOBENZOFURAN1ONE
304446206
CC1=CC=CC=C1C(=C2C3=CC=CC=C3C(=O)O2)(N+)(=O)(O)
InChI=1SC16H11NO4c110623711(10)14(17(19)20)1512845913(12)16(18)2115h29H1H3b1514+
MFCD00630813
ZINC000001784655
ZINC01784655
ZINC1784655
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