Vitas-M small molecule compound
(4Z)-1-(4-chlorophenyl)-4-(4-hydroxy-3-methoxy-5-nitrobenzylidene)pyrazolidine-3,5-dione
Catalog ID
STL431946
SMILES COc1cc(/C=C\2/C(=O)NN(C2=O)c2ccc(cc2)Cl)cc(c1O)[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 C17H12ClN3O6 MW 389.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClN3O6/c1-27-14-8-9(7-13(15(14)22)21(25)26)6-12-16(23)19-20(17(12)24)11-4-2-10(18)3-5-11/h2-8,22H,1H3,(H,19,23)/b12-6-InChIKey
KMJIUPXSIFLWHP-SDQBBNPISA-NSynonyms
(4Z)1(4CHLOROPHENYL)4((4HYDROXY3METHOXY5NITROPHENYL)METHYLENE)PYRAZOLIDINE35DIONE
(4Z)1(4CHLOROPHENYL)4((4HYDROXY3METHOXY5NITROPHENYL)METHYLIDENE)PYRAZOLIDINE35DIONE
(4Z)1(4chlorophenyl)4(4hydroxy3methoxy5nitrobenzylidene)pyrazolidine35dione
COC1=CC(=CC(=C1O)(N+)(=O)(O))C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)Cl
COc1cc(C=C2C(=O)NN(C2=O)c2ccc(cc2)Cl)cc(c1O)(N+)(=O)(O)
InChI=1SC17H12ClN3O6c1271489(713(15(14)22)21(25)26)61216(23)1920(17(12)24)114210(18)3511h2822H1H3(H1923)b126
MFCD01158645
ZINC000016192701
ZINC16192701
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