Vitas-M small molecule compound
azepan-1-yl(3-nitrophenyl)methanone
Catalog ID
STK266248
SMILES O=C(c1cccc(c1)[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(14-8-3-1-2-4-9-14)11-6-5-7-12(10-11)15(17)18/h5-7,10H,1-4,8-9H2InChIKey
QZPFXAPNWAMVJA-UHFFFAOYSA-NSynonyms
37000-08-11(3NITROBENZOYL)AZEPANE
37000081
AZAPERHYDROEPINYL3NITROPHENYLKETONE
azepan1yl(3nitrophenyl)methanone
C1CCCN(CC1)C(=O)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC13H16N2O3c1613(1483124914)1165712(1011)15(17)18h5710H1489H2
MFCD00593262
O=C(c1cccc(c1)(N+)(=O)(O))N1CCCCCC1
ZINC000000123368
ZINC00123368
ZINC123368
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