Vitas-M small molecule compound
azepan-1-yl(5-chloro-2-nitrophenyl)methanone
Catalog ID
STK427659
SMILES O=C(c1cc(Cl)ccc1[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 C13H15ClN2O3 MW 282.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15ClN2O3/c14-10-5-6-12(16(18)19)11(9-10)13(17)15-7-3-1-2-4-8-15/h5-6,9H,1-4,7-8H2InChIKey
QWBLDRWIVXOQHE-UHFFFAOYSA-NSynonyms
1((5CHLORO2NITROPHENYL)CARBONYL)AZEPANE
AZAPERHYDROEPINYL5CHLORO2NITROPHENYLKETONE
azepan1yl(5chloro2nitrophenyl)methanone
C1CCCN(CC1)C(=O)C2=C(C=CC(=C2)Cl)(N+)(=O)(O)
InChI=1SC13H15ClN2O3c14105612(16(18)19)11(910)13(17)1573124815h569H1478H2
MFCD01351558
O=C(c1cc(Cl)ccc1(N+)(=O)(O))N1CCCCCC1
ZINC000002741388
ZINC02741388
ZINC2741388
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