Vitas-M small molecule compound

4-(hydroxymethyl)-2-(2-methyl-5-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione

Catalog ID
STL387202
SMILES OCC12C=CC(O1)C1C2C(=O)N(C1=O)c1cc(ccc1C)[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 C16H14N2O6 MW 330.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O6/c1-8-2-3-9(18(22)23)6-10(8)17-14(20)12-11-4-5-16(7-19,24-11)13(12)15(17)21/h2-6,11-13,19H,7H2,1H3
InChIKey
GAVVTURRVRJOGN-UHFFFAOYSA-N
Synonyms

4(hydroxymethyl)2(2methyl5nitrophenyl)3a477atetrahydro1H47epoxyisoindole13(2H)dione
7(hydroxymethyl)2(2methyl5nitrophenyl)47adihydro3aHoctahydro1H47epoxyisoindole13dione
CC1=C(C=C(C=C1)(N+)(=O)(O))N2C(=O)C3C4C=CC(C3C2=O)(O4)CO
InChI=1SC16H14N2O6c18239(18(22)23)610(8)1714(20)12114516(7192411)13(12)15(17)21h26111319H7H21H3
MFCD02272735
OCC12C=CC(O1)C1C2C(=O)N(C1=O)c1cc(ccc1C)(N+)(=O)(O)
ZINC000104572305
ZINC000245226594

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Available files

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