Vitas-M small molecule compound

methyl 2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK269115
SMILES COC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)[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 C16H10N2O6 MW 326.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N2O6/c1-24-16(21)9-5-6-12-13(7-9)15(20)17(14(12)19)10-3-2-4-11(8-10)18(22)23/h2-8H,1H3
InChIKey
VDOJBJNUQWTLHR-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC(=CC=C3)(N+)(=O)(O)
COC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC16H10N2O6c12416(21)9561213(79)15(20)17(14(12)19)1032411(810)18(22)23h28H1H3
methyl2(3nitrophenyl)13dioxo23dihydro1Hisoindole5carboxylate
METHYL2(3NITROPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
MFCD00658224
ZINC000000243732
ZINC00243732
ZINC243732

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Available files

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