Vitas-M small molecule compound
(2E)-3-(3-chloro-1-benzofuran-2-yl)-1-(2-hydroxy-5-methoxyphenyl)prop-2-en-1-one
Catalog ID
STL322614
SMILES COc1ccc(c(c1)C(=O)/C=C/c1oc2c(c1Cl)cccc2)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 C18H13ClO4 MW 328.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClO4/c1-22-11-6-7-14(20)13(10-11)15(21)8-9-17-18(19)12-4-2-3-5-16(12)23-17/h2-10,20H,1H3/b9-8+InChIKey
GEVNAILITVNQMW-CMDGGOBGSA-NSynonyms
87487-52-3(2E)3(3chloro1benzofuran2yl)1(2hydroxy5methoxyphenyl)prop2en1one
(E)3(3CHLORO1BENZOFURAN2YL)1(2HYDROXY5METHOXYPHENYL)PROP2EN1ONE
(E)3(3chlorobenzofuran2yl)1(2hydroxy5methoxyphenyl)prop2en1one
87487523
COC1=CC(=C(C=C1)O)C(=O)C=CC2=C(C3=CC=CC=C3O2)Cl
COc1ccc(c(c1)C(=O)C=Cc1oc2c(c1Cl)cccc2)O
InChI=1SC18H13ClO4c122116714(20)13(1011)15(21)891718(19)12423516(12)2317h21020H1H3b98+
MFCD00525354
ZINC000004771937
ZINC04771937
ZINC4771937
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