Vitas-M small molecule compound
(2E)-1-(4-chloro-2-hydroxyphenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-en-1-one
Catalog ID
STK856206
SMILES Clc1ccc(c(c1)O)C(=O)/C=C/c1ccc2c(c1)OCCCO2
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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 C18H15ClO4 MW 330.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClO4/c19-13-4-5-14(16(21)11-13)15(20)6-2-12-3-7-17-18(10-12)23-9-1-8-22-17/h2-7,10-11,21H,1,8-9H2/b6-2+InChIKey
GVOZIOWVTNRWID-QHHAFSJGSA-NSynonyms
202805-37-6(2E)1(4chloro2hydroxyphenyl)3(34dihydro2H15benzodioxepin7yl)prop2en1one
(2E)3(2H3H4HBENZO(B)14DIOXEPAN7YL)1(4CHLORO2HYDROXYPHENYL)PROP2EN1ONE
(E)1(4CHLORO2HYDROXYPHENYL)3(34DIHYDRO2H15BENZODIOXEPIN7YL)PROP2EN1ONE
(E)1(4chloro2hydroxyphenyl)3(34dihydro2Hbenzo(b)(14)dioxepin7yl)prop2en1one
202805376
C1COC2=C(C=C(C=C2)C=CC(=O)C3=C(C=C(C=C3)Cl)O)OC1
Clc1ccc(c(c1)O)C(=O)C=Cc1ccc2c(c1)OCCCO2
InChI=1SC18H15ClO4c19134514(16(21)1113)15(20)6212371718(1012)239182217h27101121H189H2b62+
MFCD00181404
ZINC000004738052
ZINC04738052
ZINC4738052
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