Vitas-M small molecule compound

ethyl (2Z)-2-({2-[(4-nitrophenyl)carbonyl]hydrazinyl}methylidene)-3-oxobutanoate

Catalog ID
STK675521
SMILES CCOC(=O)/C(=C\NNC(=O)c1ccc(cc1)[N+](=O)[O-])/C(=O)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 C14H15N3O6 MW 321.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O6/c1-3-23-14(20)12(9(2)18)8-15-16-13(19)10-4-6-11(7-5-10)17(21)22/h4-8,15H,3H2,1-2H3,(H,16,19)/b12-8-
InChIKey
YBXYQFPFLCJLTC-WQLSENKSSA-N
Synonyms

CCOC(=O)C(=CNNC(=O)C1=CC=C(C=C1)(N+)(=O)(O))C(=O)C
CCOC(=O)C(=CNNC(=O)c1ccc(cc1)(N+)(=O)(O))C(=O)C
ETHYL(2Z)2((2((4NITROPHENYL)CARBONYL)HYDRAZINYL)METHYLIDENE)3OXOBUTANOATE
ETHYL(2Z)2((2(4NITROBENZOYL)HYDRAZINYL)METHYLIDENE)3OXOBUTANOATE
InChI=1SC14H15N3O6c132314(20)12(9(2)18)8151613(19)104611(7510)17(21)22h4815H3H212H3(H1619)b128
MFCD01822011
ZINC000015188709
ZINC15188709

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.