Vitas-M small molecule compound
2-bromo-6-methoxy-4-[(E)-{2-[(2-nitrophenoxy)acetyl]hydrazinylidene}methyl]phenyl 4-methylbenzoate
Catalog ID
STK181464
SMILES COc1cc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])cc(c1OC(=O)c1ccc(cc1)C)Br
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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 C24H20BrN3O7 MW 542.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrN3O7/c1-15-7-9-17(10-8-15)24(30)35-23-18(25)11-16(12-21(23)33-2)13-26-27-22(29)14-34-20-6-4-3-5-19(20)28(31)32/h3-13H,14H2,1-2H3,(H,27,29)/b26-13+InChIKey
USIMNBXEBHYTKE-LGJNPRDNSA-NSynonyms
(2bromo6methoxy4((E)((2(2nitrophenoxy)acetyl)hydrazinylidene)methyl)phenyl)4methylbenzoate
2BROMO6METHOXY4((E)(2((2NITROPHENOXY)ACETYL)HYDRAZINYLIDENE)METHYL)PHENYL4METHYLBENZOATE
4((1E)2(2(2NITROPHENOXY)ACETYLAMINO)2AZAVINYL)2BROMO6METHOXYPHENYL4METHYLBENZOATE
CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)C=NNC(=O)COC3=CC=CC=C3(N+)(=O)(O))OC
COc1cc(C=NNC(=O)COc2ccccc2(N+)(=O)(O))cc(c1OC(=O)c1ccc(cc1)C)Br
InChI=1SC24H20BrN3O7c1157917(10815)24(30)352318(25)1116(1221(23)332)13262722(29)143420643519(20)28(31)32h313H14H212H3(H2729)b2613+
MFCD00787045
ZINC000003102436
ZINC101708310
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