Vitas-M small molecule compound
5-methyl-8-nitro-3-(4-nitrophenyl)-4H-1,2,4-benzoxadiazine
Catalog ID
STK756038
SMILES [O-][N+](=O)c1ccc(cc1)C1=NOc2c(N1)c(C)ccc2[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 C14H10N4O5 MW 314.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10N4O5/c1-8-2-7-11(18(21)22)13-12(8)15-14(16-23-13)9-3-5-10(6-4-9)17(19)20/h2-7H,1H3,(H,15,16)InChIKey
UHDLZQOVKXUCML-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)C1=NOc2c(N1)c(C)ccc2(N+)(=O)(O)
5METHYL8NITRO3(4NITROPHENYL)2H124BENZOXADIAZINE
5methyl8nitro3(4nitrophenyl)4H124benzoxadiazine
5METHYL8NITRO3(4NITROPHENYL)4HBENZO(124)OXADIAZINE
8NITRO3(4NITROPHENYL)5METHYL4H124BENZOXADIAZINE
CC1=C2C(=C(C=C1)(N+)(=O)(O))ONC(=N2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC14H10N4O5c182711(18(21)22)1312(8)1514(162313)93510(649)17(19)20h27H1H3(H1516)
MFCD01240569
ZINC000006167738
ZINC06167738
ZINC6167738
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