Vitas-M small molecule compound
(4Z)-4-(2,3-dichlorobenzylidene)-6,7-dimethoxy-1,4-dihydro-3H-isochromen-3-one
Catalog ID
STL152213
SMILES COc1cc2c(cc1OC)COC(=O)/C/2=C\c1cccc(c1Cl)Cl
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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 C18H14Cl2O4 MW 365.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14Cl2O4/c1-22-15-7-11-9-24-18(21)13(12(11)8-16(15)23-2)6-10-4-3-5-14(19)17(10)20/h3-8H,9H2,1-2H3/b13-6-InChIKey
HJHPWCCPOBPLTI-MLPAPPSSSA-NSynonyms
(4Z)4((23DICHLOROPHENYL)METHYLIDENE)67DIMETHOXY1HISOCHROMEN3ONE
(4Z)4(23dichlorobenzylidene)67dimethoxy14dihydro3Hisochromen3one
4(23dichlorobenzylidene)67dimethoxyisochroman3one
COC1=C(C=C2C(=C1)COC(=O)C2=CC3=C(C(=CC=C3)Cl)Cl)OC
COc1cc2c(cc1OC)COC(=O)C2=Cc1cccc(c1Cl)Cl
InChI=1SC18H14Cl2O4c1221571192418(21)13(12(11)816(15)232)61043514(19)17(10)20h38H9H212H3b136
MFCD05677562
ZINC000002442911
ZINC02442911
ZINC2442911
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