Vitas-M small molecule compound
7-methyl-1,3-dinitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Catalog ID
STK767981
SMILES Cc1ccc2c(c1)Oc1cc(cc(c1C(=O)N2)[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 C14H9N3O6 MW 315.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9N3O6/c1-7-2-3-9-11(4-7)23-12-6-8(16(19)20)5-10(17(21)22)13(12)14(18)15-9/h2-6H,1H3,(H,15,18)InChIKey
QZZJXDWHWCFAIV-UHFFFAOYSA-NSynonyms
2METHYL79DINITRO5HBENZO(B)(14)BENZOXAZEPIN6ONE
7METHYL13DINITRO10HDIBENZO(BF)14OXAZAPERHYDROEPIN11ONE
7methyl13dinitrodibenzo(bf)(14)oxazepin11(10H)one
CC1=CC2=C(C=C1)NC(=O)C3=C(C=C(C=C3O2)(N+)(=O)(O))(N+)(=O)(O)
Cc1ccc2c(c1)Oc1cc(cc(c1C(=O)N2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC14H9N3O6c1723911(47)231268(16(19)20)510(17(21)22)13(12)14(18)159h26H1H3(H1518)
MFCD03308558
ZINC000002513410
ZINC02513410
ZINC2513410
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