Vitas-M small molecule compound
2-formylphenyl 3-methyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxylate
Catalog ID
STL017449
SMILES O=Cc1ccccc1OC(=O)C1(C)OC(=O)c2c(C1)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 C18H14O5 MW 310.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14O5/c1-18(10-12-6-2-4-8-14(12)16(20)23-18)17(21)22-15-9-5-3-7-13(15)11-19/h2-9,11H,10H2,1H3InChIKey
SHFPLOPEFXLYBH-UHFFFAOYSA-NSynonyms
(2formylphenyl)3methyl1oxo4Hisochromene3carboxylate
2formylphenyl3methyl1oxo34dihydro1Hisochromene3carboxylate
2FORMYLPHENYL3METHYL1OXOISOCHROMANE3CARBOXYLATE
CC1(CC2=CC=CC=C2C(=O)O1)C(=O)OC3=CC=CC=C3C=O
InChI=1SC18H14O5c118(1012624814(12)16(20)2318)17(21)2215953713(15)1119h2911H10H21H3
MFCD05847580
ZINC000005235389
ZINC000005235390
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