(E)-4-methyl-6-(7-methyl-4-oxidanyl-3-oxidanylidene-6-phenyl-1H-2-benzofuran-5-yl)hex-4-enoic acid

Systemtic Name: (E)-4-methyl-6-(7-methyl-4-oxidanyl-3-oxidanylidene-6-phenyl-1H-2-benzofuran-5-yl)hex-4-enoic acid Openeye Name: (E)-6-(4-hydroxy-7-methyl-3-oxo-6-phenyl-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid CAS Name: (E)-6-(4-hydroxy-7-methyl-3-oxo-6-phenyl-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid IUPAC Name: (E)-6-(4-hydroxy-7-methyl-3-oxo-6-phenyl-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid Traditional Name: (E)-6-(4-hydroxy-3-keto-7-methyl-6-phenyl-phthalan-5-yl)-4-methyl-hex-4-enoic acid Formula: C22H22O5 MolecularWeight: 366.40708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(\C)/CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C22H22O5/c1-13(9-11-18(23)24)8-10-16-19(15-6-4-3-5-7-15)14(2)17-12-27-22(26)20(17)21(16)25/h3-8,25H,9-12H2,1-2H3,(H,23,24)/b13-8+