dimethyl 2-[(E)-4-(4,6-dimethoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-2-methyl-but-2-enyl]propanedioate

Systemtic Name: dimethyl 2-[(E)-4-(4,6-dimethoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-2-methyl-but-2-enyl]propanedioate Openeye Name: dimethyl 2-[(E)-4-(4,6-dimethoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-2-methyl-but-2-enyl]propanedioate CAS Name: 2-[(E)-4-(4,6-dimethoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-2-methylbut-2-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E)-4-(4,6-dimethoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-2-methylbut-2-enyl]propanedioate Traditional Name: 2-[(E)-4-(3-keto-4,6-dimethoxy-7-methyl-phthalan-5-yl)-2-methyl-but-2-enyl]malonic acid dimethyl ester Formula: C21H26O8 MolecularWeight: 406.42634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)OC)CC=C(C)CC(C(=O)OC)C(=O)OC)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)OC)C/C=C(\C)/CC(C(=O)OC)C(=O)OC)OC

InChI

InChI=1S/C21H26O8/c1-11(9-14(19(22)27-5)20(23)28-6)7-8-13-17(25-3)12(2)15-10-29-21(24)16(15)18(13)26-4/h7,14H,8-10H2,1-6H3/b11-7+