Vitas-M small molecule compound
4-[(2E)-2-(4-{[(4-tert-butylphenyl)carbonyl]oxy}-3-ethoxybenzylidene)hydrazinyl]benzoic acid
Catalog ID
STL342813
SMILES CCOc1cc(/C=N/Nc2ccc(cc2)C(=O)O)ccc1OC(=O)c1ccc(cc1)C(C)(C)C
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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 C27H28N2O5 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O5/c1-5-33-24-16-18(17-28-29-22-13-9-19(10-14-22)25(30)31)6-15-23(24)34-26(32)20-7-11-21(12-8-20)27(2,3)4/h6-17,29H,5H2,1-4H3,(H,30,31)/b28-17+InChIKey
NJFNNUHNOFZZSH-OGLMXYFKSA-NSynonyms
844650-03-9(E)4(2(4((4(tertbutyl)benzoyl)oxy)3ethoxybenzylidene)hydrazinyl)benzoicacid
4((2E)2((4(4tertbutylbenzoyl)oxy3ethoxyphenyl)methylidene)hydrazinyl)benzoicacid
4((2E)2(4(((4tertbutylphenyl)carbonyl)oxy)3ethoxybenzylidene)hydrazinyl)benzoicacid
844650039
CCOC1=C(C=CC(=C1)C=NNC2=CC=C(C=C2)C(=O)O)OC(=O)C3=CC=C(C=C3)C(C)(C)C
CCOc1cc(C=NNc2ccc(cc2)C(=O)O)ccc1OC(=O)c1ccc(cc1)C(C)(C)C
InChI=1SC27H28N2O5c1533241618(1728292213919(101422)25(30)31)61523(24)3426(32)2071121(12820)27(23)4h61729H5H214H3(H3031)b2817+
MFCD04159000
ZINC000013758817
ZINC33695149
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