Vitas-M small molecule compound
3-[(E)-{2-[(2,4,6-tribromophenoxy)acetyl]hydrazinylidene}methyl]phenyl 4-nitrobenzoate
Catalog ID
STK667719
SMILES O=C(COc1c(Br)cc(cc1Br)Br)N/N=C/c1cccc(c1)OC(=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 C22H14Br3N3O6 MW 656.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14Br3N3O6/c23-15-9-18(24)21(19(25)10-15)33-12-20(29)27-26-11-13-2-1-3-17(8-13)34-22(30)14-4-6-16(7-5-14)28(31)32/h1-11H,12H2,(H,27,29)/b26-11+InChIKey
XZWQAKMFYHKVOS-KBKYJPHKSA-NSynonyms
(3((E)((2(246tribromophenoxy)acetyl)hydrazinylidene)methyl)phenyl)4nitrobenzoate
3((E)(2((246tribromophenoxy)acetyl)hydrazinylidene)methyl)phenyl4nitrobenzoate
C1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C=NNC(=O)COC3=C(C=C(C=C3Br)Br)Br
InChI=1SC22H14Br3N3O6c2315918(24)21(19(25)1015)331220(29)2726111321317(813)3422(30)144616(7514)28(31)32h111H12H2(H2729)b2611+
MFCD00323166
O=C(COc1c(Br)cc(cc1Br)Br)NN=Cc1cccc(c1)OC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000150350156
ZINC150548710
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