Vitas-M small molecule compound
1'-(2-chlorobenzyl)-5-methyl-5-nitrospiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Catalog ID
STK780983
SMILES Clc1ccccc1CN1c2ccccc2C2(C1=O)OCC(CO2)(C)[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 C19H17ClN2O5 MW 388.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN2O5/c1-18(22(24)25)11-26-19(27-12-18)14-7-3-5-9-16(14)21(17(19)23)10-13-6-2-4-8-15(13)20/h2-9H,10-12H2,1H3InChIKey
BFCDOJQJHMHDON-UHFFFAOYSA-NSynonyms
1((2CHLOROPHENYL)METHYL)5METHYL5NITROSPIRO(13DIOXANE23INDOLE)2ONE
1(2chlorobenzyl)5methyl5nitrospiro(13dioxane23indol)2(1H)one
CC1(COC2(C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4Cl)OC1)(N+)(=O)(O)
Clc1ccccc1CN1c2ccccc2C2(C1=O)OCC(CO2)(C)(N+)(=O)(O)
InChI=1SC19H17ClN2O5c118(22(24)25)112619(271218)14735916(14)21(17(19)23)1013624815(13)20h29H1012H21H3
MFCD06014112
ZINC000004718115
ZINC04718115
ZINC4718115
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