Vitas-M small molecule compound
3-[(2-methyl-5-nitrophenyl)amino]cyclohex-2-en-1-one
Catalog ID
STK897886
SMILES O=C1CCCC(=C1)Nc1cc(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 C13H14N2O3 MW 246.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O3/c1-9-5-6-11(15(17)18)8-13(9)14-10-3-2-4-12(16)7-10/h5-8,14H,2-4H2,1H3InChIKey
SGRXVUBUSDQRPA-UHFFFAOYSA-NSynonyms
1217862-42-41217862424
3((2methyl5nitrophenyl)amino)cyclohex2en1one
3(2methyl5nitroanilino)cyclohex2en1one
CC1=C(C=C(C=C1)(N+)(=O)(O))NC2=CC(=O)CCC2
InChI=1SC13H14N2O3c195611(15(17)18)813(9)141032412(16)710h5814H24H21H3
MFCD15146480
O=C1CCCC(=C1)Nc1cc(ccc1C)(N+)(=O)(O)
ZINC000040488496
ZINC40488496
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