Vitas-M small molecule compound
3-ethyl-1,5-dinitro-9-(2-oxo-2-phenylethyl)-3-azabicyclo[3.3.1]non-7-en-6-one
Catalog ID
STK679240
SMILES CCN1CC2(C=CC(=O)C(C1)(C2CC(=O)c1ccccc1)[N+](=O)[O-])[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 C18H19N3O6 MW 373.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O6/c1-2-19-11-17(20(24)25)9-8-16(23)18(12-19,21(26)27)15(17)10-14(22)13-6-4-3-5-7-13/h3-9,15H,2,10-12H2,1H3InChIKey
QEYYRLFQAWSBIA-UHFFFAOYSA-NSynonyms
3ETHYL15BISNITRO9(2OXO2PHENYLETHYL)3AZABICYCLO(331)NON7EN6ONE
3ethyl15dinitro9(2oxo2phenylethyl)3azabicyclo(331)non7en6one
7ETHYL15DINITRO9(2OXO2PHENYLETHYL)7AZABICYCLO(331)NON3EN2ONE
7ETHYL15DINITRO9PHENACYL7AZABICYCLO(331)NON2EN4ONE
CCN1CC2(C=CC(=O)C(C1)(C2CC(=O)c1ccccc1)(N+)(=O)(O))(N+)(=O)(O)
CCN1CC2(C=CC(=O)C(C1)(C2CC(=O)C3=CC=CC=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC18H19N3O6c12191117(20(24)25)9816(23)18(121921(26)27)15(17)1014(22)136435713h3915H21012H21H3
MFCD03269033
ZINC000019943949
ZINC000252430889
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