Vitas-M small molecule compound
2-methoxy-3-nitro-4-[(E)-{2-[(2-nitrophenoxy)acetyl]hydrazinylidene}methyl]phenyl acetate
Catalog ID
STK181434
SMILES COc1c(ccc(c1[N+](=O)[O-])/C=N/NC(=O)COc1ccccc1[N+](=O)[O-])OC(=O)C
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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 C18H16N4O9 MW 432.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O9/c1-11(23)31-15-8-7-12(17(22(27)28)18(15)29-2)9-19-20-16(24)10-30-14-6-4-3-5-13(14)21(25)26/h3-9H,10H2,1-2H3,(H,20,24)/b19-9+InChIKey
IEBHAPUCTUXLOL-DJKKODMXSA-NSynonyms
(2methoxy3nitro4((E)((2(2nitrophenoxy)acetyl)hydrazinylidene)methyl)phenyl)acetate
2METHOXY3NITRO4((E)(2((2NITROPHENOXY)ACETYL)HYDRAZINYLIDENE)METHYL)PHENYLACETATE
CC(=O)OC1=C(C(=C(C=C1)C=NNC(=O)COC2=CC=CC=C2(N+)(=O)(O))(N+)(=O)(O))OC
COc1c(ccc(c1(N+)(=O)(O))C=NNC(=O)COc1ccccc1(N+)(=O)(O))OC(=O)C
InChI=1SC18H16N4O9c111(23)31158712(17(22(27)28)18(15)292)9192016(24)103014643513(14)21(25)26h39H10H212H3(H2024)b199+
MFCD00739739
ZINC000003085576
ZINC96838846
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