Vitas-M small molecule compound
2-methoxy-4-[(E)-{2-[(2,4,6-tribromophenoxy)acetyl]hydrazinylidene}methyl]phenyl 4-nitrobenzoate
Catalog ID
STK667712
SMILES COc1cc(/C=N/NC(=O)COc2c(Br)cc(cc2Br)Br)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 C23H16Br3N3O7 MW 686.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16Br3N3O7/c1-34-20-8-13(2-7-19(20)36-23(31)14-3-5-16(6-4-14)29(32)33)11-27-28-21(30)12-35-22-17(25)9-15(24)10-18(22)26/h2-11H,12H2,1H3,(H,28,30)/b27-11+InChIKey
XSGNZNOMOYASQE-LUOAPIJWSA-NSynonyms
(2methoxy4((E)((2(246tribromophenoxy)acetyl)hydrazinylidene)methyl)phenyl)4nitrobenzoate
2methoxy4((E)(2((246tribromophenoxy)acetyl)hydrazinylidene)methyl)phenyl4nitrobenzoate
COC1=C(C=CC(=C1)C=NNC(=O)COC2=C(C=C(C=C2Br)Br)Br)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
COc1cc(C=NNC(=O)COc2c(Br)cc(cc2Br)Br)ccc1OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC23H16Br3N3O7c13420813(2719(20)3623(31)143516(6414)29(32)33)11272821(30)12352217(25)915(24)1018(22)26h211H12H21H3(H2830)b2711+
MFCD00313827
ZINC000150350139
ZINC150607627
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