Vitas-M small molecule compound
4-[(E)-{2-[(4-chlorophenoxy)acetyl]hydrazinylidene}methyl]-2-methoxyphenyl 4-nitrobenzoate
Catalog ID
STK746129
SMILES COc1cc(/C=N/NC(=O)COc2ccc(cc2)Cl)ccc1OC(=O)c1ccc(cc1)[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 C23H18ClN3O7 MW 483.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O7/c1-32-21-12-15(13-25-26-22(28)14-33-19-9-5-17(24)6-10-19)2-11-20(21)34-23(29)16-3-7-18(8-4-16)27(30)31/h2-13H,14H2,1H3,(H,26,28)/b25-13+InChIKey
XXXFWNFAYLFFRG-DHRITJCHSA-NSynonyms
(4((E)((2(4chlorophenoxy)acetyl)hydrazinylidene)methyl)2methoxyphenyl)4nitrobenzoate
4((E)(2((4chlorophenoxy)acetyl)hydrazinylidene)methyl)2methoxyphenyl4nitrobenzoate
COC1=C(C=CC(=C1)C=NNC(=O)COC2=CC=C(C=C2)Cl)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
COc1cc(C=NNC(=O)COc2ccc(cc2)Cl)ccc1OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC23H18ClN3O7c132211215(13252622(28)1433199517(24)61019)21120(21)3423(29)163718(8416)27(30)31h213H14H21H3(H2628)b2513+
MFCD00824015
ZINC000001056117
ZINC33295717
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