Vitas-M small molecule compound
(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one
Catalog ID
STL311411
SMILES COc1cc2c(cc1OC)C/C(=C/c1cc(Cl)cc3c1OCOC3)/C2=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 C20H17ClO5 MW 372.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClO5/c1-23-17-7-11-3-12(19(22)16(11)8-18(17)24-2)4-13-5-15(21)6-14-9-25-10-26-20(13)14/h4-8H,3,9-10H2,1-2H3/b12-4-InChIKey
DQTZYCQQUOECMI-QCDXTXTGSA-NSynonyms
1436015-57-4(2Z)2((6chloro4H13benzodioxin8yl)methylidene)56dimethoxy23dihydro1Hinden1one
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)56dimethoxy3Hinden1one
(Z)2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)56dimethoxy23dihydro1Hinden1one
1436015574
COC1=C(C=C2C(=C1)CC(=CC3=CC(=CC4=C3OCOC4)Cl)C2=O)OC
COc1cc2c(cc1OC)CC(=Cc1cc(Cl)cc3c1OCOC3)C2=O
InChI=1SC20H17ClO5c12317711312(19(22)16(11)818(17)242)413515(21)614925102620(13)14h48H3910H212H3b124
MFCD23138905
ZINC000095474040
ZINC95474040
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