Vitas-M small molecule compound

(4Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxybenzylidene)-1,3-oxazol-5(4H)-one

Catalog ID
STK753792
SMILES COc1ccc(cc1)/C=C/1\N=C(OC1=O)c1ccc2c(c1)OCO2

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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 C18H13NO5 MW 323.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13NO5/c1-21-13-5-2-11(3-6-13)8-14-18(20)24-17(19-14)12-4-7-15-16(9-12)23-10-22-15/h2-9H,10H2,1H3/b14-8-
InChIKey
HSFSQVKOLXYJDV-ZSOIEALJSA-N
Synonyms

(4Z)2(13BENZODIOXOL5YL)4((4METHOXYPHENYL)METHYLIDENE)13OXAZOL5ONE
(4Z)2(13benzodioxol5yl)4(4methoxybenzylidene)13oxazol5(4H)one
COC1=CC=C(C=C1)C=C2C(=O)OC(=N2)C3=CC4=C(C=C3)OCO4
COc1ccc(cc1)C=C1N=C(OC1=O)c1ccc2c(c1)OCO2
InChI=1SC18H13NO5c121135211(3613)81418(20)2417(1914)12471516(912)23102215h29H10H21H3b148
MFCD00824576
ZINC000000062286
ZINC00062286
ZINC62286

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Available files

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