Vitas-M small molecule compound

2-(3-chlorophenoxy)-N'-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]acetohydrazide

Catalog ID
STK190438
SMILES O=C(COc1cccc(c1)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 C16H12ClN3O6 MW 377.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN3O6/c17-11-2-1-3-12(5-11)24-8-16(21)19-18-7-10-4-14-15(26-9-25-14)6-13(10)20(22)23/h1-7H,8-9H2,(H,19,21)/b18-7-
InChIKey
IDPIVVVYEPEPSF-WSVATBPTSA-N
Synonyms

2(3CHLOROPHENOXY)N((Z)(6NITRO13BENZODIOXOL5YL)METHYLIDENE)ACETOHYDRAZIDE
2(3CHLOROPHENOXY)N((Z)(6NITRO13BENZODIOXOL5YL)METHYLIDENEAMINO)ACETAMIDE
C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)COC3=CC(=CC=C3)Cl)(N+)(=O)(O)
InChI=1SC16H12ClN3O6c171121312(511)24816(21)191871041415(2692514)613(10)20(22)23h17H89H2(H1921)b187
MFCD02913965
O=C(COc1cccc(c1)Cl)NN=Cc1cc2OCOc2cc1(N+)(=O)(O)
ZINC000004724122
ZINC00704582
ZINC704582

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Available files

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