Vitas-M small molecule compound
13,13-dimethyl-10-nitro-11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine
Catalog ID
STK772660
SMILES [O-][N+](=O)c1ccc2c(c1)C1OC(C)(C)c3c(N1CO2)cccc3
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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 C17H16N2O4 MW 312.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O4/c1-17(2)13-5-3-4-6-14(13)18-10-22-15-8-7-11(19(20)21)9-12(15)16(18)23-17/h3-9,16H,10H2,1-2H3InChIKey
DCSFIIWJFRXDHK-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc2c(c1)C1OC(C)(C)c3c(N1CO2)cccc3
1313dimethyl10nitro11bH13H(13)benzoxazino(34a)(31)benzoxazine
1313dimethyl10nitro611bdihydro(13)benzoxazino(34a)(31)benzoxazine
CC1(C2=CC=CC=C2N3COC4=C(C3O1)C=C(C=C4)(N+)(=O)(O))C
InChI=1SC17H16N2O4c117(2)13534614(13)181022158711(19(20)21)912(15)16(18)2317h3916H10H212H3
MFCD03820537
ZINC000000108066
ZINC000000108068
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