Vitas-M small molecule compound
4-[(E)-{2-[(4-methoxyphenyl)carbonyl]hydrazinylidene}methyl]phenyl 3,5-dinitrobenzoate
Catalog ID
STK753855
SMILES COc1ccc(cc1)C(=O)N/N=C/c1ccc(cc1)OC(=O)c1cc(cc(c1)[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 C22H16N4O8 MW 464.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O8/c1-33-19-8-4-15(5-9-19)21(27)24-23-13-14-2-6-20(7-3-14)34-22(28)16-10-17(25(29)30)12-18(11-16)26(31)32/h2-13H,1H3,(H,24,27)/b23-13+InChIKey
WCAPIHDWMUXRJZ-YDZHTSKRSA-NSynonyms
(4((E)((4methoxybenzoyl)hydrazinylidene)methyl)phenyl)35dinitrobenzoate
4((E)(2((4methoxyphenyl)carbonyl)hydrazinylidene)methyl)phenyl35dinitrobenzoate
COC1=CC=C(C=C1)C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
COc1ccc(cc1)C(=O)NN=Cc1ccc(cc1)OC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC22H16N4O8c133198415(5919)21(27)242313142620(7314)3422(28)161017(25(29)30)1218(1116)26(31)32h213H1H3(H2427)b2313+
MFCD00824725
ZINC000003117323
ZINC102872907
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