Vitas-M small molecule compound
(2E)-1-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)prop-2-en-1-one
Catalog ID
STK306295
SMILES COc1cccc(c1)/C=C/C(=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 C17H14O4 MW 282.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14O4/c1-19-14-4-2-3-12(9-14)5-7-15(18)13-6-8-16-17(10-13)21-11-20-16/h2-10H,11H2,1H3/b7-5+InChIKey
INETVQKSJAGWIA-FNORWQNLSA-NSynonyms
561046-16-0(2E)1(13benzodioxol5yl)3(3methoxyphenyl)prop2en1one
(2E)1(2HBENZO(34D)13DIOXOLAN5YL)3(3METHOXYPHENYL)PROP2EN1ONE
(E)1(13BENZODIOXOL5YL)3(3METHOXYPHENYL)PROP2EN1ONE
1(13BENZODIOXOLE5YL)3(3METHOXYPHENYL)2PROPENE1ONE
561046160
COC1=CC=CC(=C1)C=CC(=O)C2=CC3=C(C=C2)OCO3
COc1cccc(c1)C=CC(=O)c1ccc2c(c1)OCO2
InChI=1SC17H14O4c1191442312(914)5715(18)13681617(1013)21112016h210H11H21H3b75+
MFCD04052807
ZINC000005129132
ZINC05129132
ZINC5129132
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