Vitas-M small molecule compound
2-(4-chloro-3,5-dimethylphenoxy)-N'-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]acetohydrazide
Catalog ID
STK399070
SMILES O=C(COc1cc(C)c(c(c1)C)Cl)N/N=C/c1cc2OCOc2cc1[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 C18H16ClN3O6 MW 405.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClN3O6/c1-10-3-13(4-11(2)18(10)19)26-8-17(23)21-20-7-12-5-15-16(28-9-27-15)6-14(12)22(24)25/h3-7H,8-9H2,1-2H3,(H,21,23)/b20-7+InChIKey
VZEQRHMFGNVUEI-IFRROFPPSA-NSynonyms
2(4chloro35dimethylphenoxy)N((E)(6nitro13benzodioxol5yl)methylidene)acetohydrazide
2(4chloro35dimethylphenoxy)N((E)(6nitro13benzodioxol5yl)methylideneamino)acetamide
CC1=CC(=CC(=C1Cl)C)OCC(=O)NN=CC2=CC3=C(C=C2(N+)(=O)(O))OCO3
InChI=1SC18H16ClN3O6c110313(411(2)18(10)19)26817(23)212071251516(2892715)614(12)22(24)25h37H89H212H3(H2123)b207+
MFCD01148785
O=C(COc1cc(C)c(c(c1)C)Cl)NN=Cc1cc2OCOc2cc1(N+)(=O)(O)
ZINC000005539915
ZINC97024169
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