Vitas-M small molecule compound
2-{4-[(2-chlorobenzyl)oxy]-3-ethoxy-5-(prop-2-en-1-yl)benzylidene}-1H-indene-1,3(2H)-dione
Catalog ID
STK362809
SMILES CCOc1cc(cc(c1OCc1ccccc1Cl)CC=C)/C=C/1\C(=O)c2c(C1=O)cccc2
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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 C28H23ClO4 MW 458.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClO4/c1-3-9-19-14-18(15-23-26(30)21-11-6-7-12-22(21)27(23)31)16-25(32-4-2)28(19)33-17-20-10-5-8-13-24(20)29/h3,5-8,10-16H,1,4,9,17H2,2H3InChIKey
JBIDWFNTHJFRCY-UHFFFAOYSA-NSynonyms
2((4((2CHLOROPHENYL)METHOXY)3ETHOXY5PROP2ENYLPHENYL)METHYLENE)CYCLOPENTA(12A)BENZENE13DIONE
2((4((2CHLOROPHENYL)METHOXY)3ETHOXY5PROP2ENYLPHENYL)METHYLIDENE)INDENE13DIONE
2(4((2CHLOROBENZYL)OXY)3ETHOXY5(PROP2EN1YL)BENZYLIDENE)1HINDENE13(2H)DIONE
CCOC1=CC(=CC(=C1OCC2=CC=CC=C2Cl)CC=C)C=C3C(=O)C4=CC=CC=C4C3=O
CCOc1cc(cc(c1OCc1ccccc1Cl)CC=C)C=C1C(=O)c2c(C1=O)cccc2
InChI=1SC28H23ClO4c139191418(152326(30)2111671222(21)27(23)31)1625(3242)28(19)33172010581324(20)29h3581016H14917H22H3
MFCD03649467
ZINC000008722176
ZINC08722176
ZINC8722176
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