Vitas-M small molecule compound
5,5-dimethyl-2-{[5-(3-nitrophenyl)furan-2-yl]methylidene}cyclohexane-1,3-dione
Catalog ID
STK809039
SMILES O=C1CC(C)(C)CC(=O)C1=Cc1ccc(o1)c1cccc(c1)[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 C19H17NO5 MW 339.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO5/c1-19(2)10-16(21)15(17(22)11-19)9-14-6-7-18(25-14)12-4-3-5-13(8-12)20(23)24/h3-9H,10-11H2,1-2H3InChIKey
NKJXNWAALQLSRS-UHFFFAOYSA-NSynonyms
392318-81-9392318819
55DIMETHYL2((5(3NITROPHENYL)FURAN2YL)METHYLENE)CYCLOHEXANE13DIONE
55dimethyl2((5(3nitrophenyl)furan2yl)methylidene)cyclohexane13dione
CC1(CC(=O)C(=CC2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)C1)C
InChI=1SC19H17NO5c119(2)1016(21)15(17(22)1119)9146718(2514)1243513(812)20(23)24h39H1011H212H3
MFCD00695951
O=C1CC(C)(C)CC(=O)C1=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O)
ZINC000000284875
ZINC00284875
ZINC284875
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