Vitas-M small molecule compound
azepan-1-yl(2-nitrophenyl)methanone
Catalog ID
STK121067
SMILES O=C(c1ccccc1[N+](=O)[O-])N1CCCCCC1
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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 C13H16N2O3 MW 248.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O3/c16-13(14-9-5-1-2-6-10-14)11-7-3-4-8-12(11)15(17)18/h3-4,7-8H,1-2,5-6,9-10H2InChIKey
GPWWPUJHEXVVNL-UHFFFAOYSA-NSynonyms
153688-70-11(2NITROBENZOYL)AZEPANE
153688701
AZAPERHYDROEPINYL2NITROPHENYLKETONE
AZEPAN1YL(2NITROPHENYL)METHANONE
C1CCCN(CC1)C(=O)C2=CC=CC=C2(N+)(=O)(O)
InChI=1SC13H16N2O3c1613(14951261014)11734812(11)15(17)18h3478H1256910H2
MFCD00596362
O=C(c1ccccc1(N+)(=O)(O))N1CCCCCC1
ZINC000000103189
ZINC00103189
ZINC103189
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