(3E,8E)-10-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4,8-dimethyl-deca-3,8-dienoic acid

Systemtic Name: (3E,8E)-10-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4,8-dimethyl-deca-3,8-dienoic acid Openeye Name: (3E,8E)-10-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4,8-dimethyl-deca-3,8-dienoic acid CAS Name: (3E,8E)-10-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4,8-dimethyldeca-3,8-dienoic acid IUPAC Name: (3E,8E)-10-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4,8-dimethyldeca-3,8-dienoic acid Traditional Name: (3E,8E)-10-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-4,8-dimethyl-deca-3,8-dienoic acid Formula: C22H28O6 MolecularWeight: 388.45412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28O6/c1-13(6-5-7-14(2)9-11-18(23)24)8-10-16-20(25)19-17(12-28-22(19)26)15(3)21(16)27-4/h8-9,25H,5-7,10-12H2,1-4H3,(H,23,24)/b13-8+,14-9+