Vitas-M small molecule compound
2-bromo-4-nitro-6-[(E)-{2-[(2,4,6-tribromophenoxy)acetyl]hydrazinylidene}methyl]phenyl 4-bromobenzoate
Catalog ID
STK672388
SMILES O=C(COc1c(Br)cc(cc1Br)Br)N/N=C/c1cc(cc(c1OC(=O)c1ccc(cc1)Br)Br)[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 C22H12Br5N3O6 MW 813.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12Br5N3O6/c23-13-3-1-11(2-4-13)22(32)36-20-12(5-15(30(33)34)8-18(20)27)9-28-29-19(31)10-35-21-16(25)6-14(24)7-17(21)26/h1-9H,10H2,(H,29,31)/b28-9+InChIKey
UXCFFWKLKTWXGI-HIUVJMHLSA-NSynonyms
(2bromo4nitro6((E)((2(246tribromophenoxy)acetyl)hydrazinylidene)methyl)phenyl)4bromobenzoate
2bromo4nitro6((E)(2((246tribromophenoxy)acetyl)hydrazinylidene)methyl)phenyl4bromobenzoate
C1=CC(=CC=C1C(=O)OC2=C(C=C(C=C2C=NNC(=O)COC3=C(C=C(C=C3Br)Br)Br)(N+)(=O)(O))Br)Br
InChI=1SC22H12Br5N3O6c23133111(2413)22(32)362012(515(30(33)34)818(20)27)9282919(31)10352116(25)614(24)717(21)26h19H10H2(H2931)b289+
MFCD00824014
O=C(COc1c(Br)cc(cc1Br)Br)NN=Cc1cc(cc(c1OC(=O)c1ccc(cc1)Br)Br)(N+)(=O)(O)
ZINC000150353414
ZINC150621280
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