Name: 2-(4-bromo-but-2-enyl)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid methyl ester
IUPAC: methyl 2-(4-bromobut-2-enyl)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
SMILES:
COC(=O)C(CC=CCBr)CC(C)=CCc1c(O)c2c(c(C)c1OC)COC2=OCanonical SMILES:
CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CC(CC=CCBr)C(=O)OC)OSummenformel: C22H27BrO6
Molare Masse: 467.30
InChIKey: FOFPUDHYVLQULX-UHFFFAOYSA-N
InChI:
PubChem CID: 67010204 →InChI=1S/C22H27BrO6/c1-13(11-15(21(25)28-4)7-5-6-10-23)8-9-16-19(24)18-17(12-29-22(18)26)14(2)20(16)27-3/h5-6,8,15,24H,7,9-12H2,1-4H3Synonyme
SCHEMBL1374252FOFPUDHYVLQULX-UHFFFAOYSA-N2-(4-bromo-but-2-enyl)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid methyl ester