Vitas-M small molecule compound
(4Z)-4-(2-chlorobenzylidene)-6,7-dimethoxy-1,4-dihydro-3H-isochromen-3-one
Catalog ID
STL466338
SMILES COc1cc2c(cc1OC)COC(=O)/C/2=C\c1ccccc1Cl
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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/c1-21-16-8-12-10-23-18(20)14(13(12)9-17(16)22-2)7-11-5-3-4-6-15(11)19/h3-9H,10H2,1-2H3/b14-7-InChIKey
HVZBKVDQMZNCGK-AUWJEWJLSA-NSynonyms
859116-35-1(4Z)4((2CHLOROPHENYL)METHYLIDENE)67DIMETHOXY1HISOCHROMEN3ONE
(4Z)4(2chlorobenzylidene)67dimethoxy14dihydro3Hisochromen3one
(Z)4(2chlorobenzylidene)67dimethoxyisochroman3one
859116351
COC1=C(C=C2C(=C1)COC(=O)C2=CC3=CC=CC=C3Cl)OC
COc1cc2c(cc1OC)COC(=O)C2=Cc1ccccc1Cl
InChI=1SC18H15ClO4c12116812102318(20)14(13(12)917(16)222)711534615(11)19h39H10H212H3b147
MFCD01073275
ZINC000002122154
ZINC02122154
ZINC2122154
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