Vitas-M small molecule compound

2-methoxy-4-[(E)-{2-[(4-methyl-2-nitrophenoxy)acetyl]hydrazinylidene}methyl]-3-nitrophenyl acetate

Catalog ID
STK256014
SMILES COc1c(ccc(c1[N+](=O)[O-])/C=N/NC(=O)COc1ccc(cc1[N+](=O)[O-])C)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 C19H18N4O9 MW 446.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O9/c1-11-4-6-15(14(8-11)22(26)27)31-10-17(25)21-20-9-13-5-7-16(32-12(2)24)19(30-3)18(13)23(28)29/h4-9H,10H2,1-3H3,(H,21,25)/b20-9+
InChIKey
SNEXRFNKBQPOOV-AWQFTUOYSA-N
Synonyms

(2methoxy4((E)((2(4methyl2nitrophenoxy)acetyl)hydrazinylidene)methyl)3nitrophenyl)acetate
2methoxy4((E)(2((4methyl2nitrophenoxy)acetyl)hydrazinylidene)methyl)3nitrophenylacetate
CC1=CC(=C(C=C1)OCC(=O)NN=CC2=C(C(=C(C=C2)OC(=O)C)OC)(N+)(=O)(O))(N+)(=O)(O)
COc1c(ccc(c1(N+)(=O)(O))C=NNC(=O)COc1ccc(cc1(N+)(=O)(O))C)OC(=O)C
InChI=1SC19H18N4O9c1114615(14(811)22(26)27)311017(25)21209135716(3212(2)24)19(303)18(13)23(28)29h49H10H213H3(H2125)b209+
MFCD00638171
ZINC000009355251
ZINC98031227

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Available files

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