Vitas-M small molecule compound
N'-[(E)-{4-methoxy-3-[(pentachlorophenoxy)methyl]phenyl}methylidene]-4-nitrobenzohydrazide
Catalog ID
STK926729
SMILES COc1ccc(cc1COc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl)/C=N/NC(=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 C22H14Cl5N3O5 MW 577.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14Cl5N3O5/c1-34-15-7-2-11(9-28-29-22(31)12-3-5-14(6-4-12)30(32)33)8-13(15)10-35-21-19(26)17(24)16(23)18(25)20(21)27/h2-9H,10H2,1H3,(H,29,31)/b28-9+InChIKey
QPHNFKVPHWLNFC-HIUVJMHLSA-NSynonyms
COC1=C(C=C(C=C1)C=NNC(=O)C2=CC=C(C=C2)(N+)(=O)(O))COC3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)Cl
COc1ccc(cc1COc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl)C=NNC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H14Cl5N3O5c134157211(9282922(31)123514(6412)30(32)33)813(15)10352119(26)17(24)16(23)18(25)20(21)27h29H10H21H3(H2931)b289+
MFCD02128300
N((E)(4methoxy3((23456pentachlorophenoxy)methyl)phenyl)methylideneamino)4nitrobenzamide
N((E)(4methoxy3((pentachlorophenoxy)methyl)phenyl)methylidene)4nitrobenzohydrazide
ZINC000002807136
ZINC100292292
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