Vitas-M small molecule compound
2-chloro-4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-methoxybenzoate
Catalog ID
STK899266
SMILES COc1ccc(cc1)C(=O)Oc1ccc(cc1Cl)/C=N/NC(=O)c1cccc(c1)[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 C22H16ClN3O6 MW 453.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O6/c1-31-18-8-6-15(7-9-18)22(28)32-20-10-5-14(11-19(20)23)13-24-25-21(27)16-3-2-4-17(12-16)26(29)30/h2-13H,1H3,(H,25,27)/b24-13+InChIKey
PWKPBTBHLBPGPW-ZMOGYAJESA-NSynonyms
402768-41-6(2chloro4((E)((3nitrobenzoyl)hydrazinylidene)methyl)phenyl)4methoxybenzoate
2chloro4((E)(2((3nitrophenyl)carbonyl)hydrazinylidene)methyl)phenyl4methoxybenzoate
402768416
COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=O)C3=CC(=CC=C3)(N+)(=O)(O))Cl
COc1ccc(cc1)C(=O)Oc1ccc(cc1Cl)C=NNC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC22H16ClN3O6c131188615(7918)22(28)322010514(1119(20)23)13242521(27)1632417(1216)26(29)30h213H1H3(H2527)b2413+
MFCD02605032
ZINC000002801850
ZINC33412408
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