(E)-5-(4-acetyloxy-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-2-cycloheptyl-pent-3-enoic acid

Systemtic Name: (E)-5-(4-acetyloxy-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-2-cycloheptyl-pent-3-enoic acid Openeye Name: (E)-5-(4-acetoxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-2-cycloheptyl-pent-3-enoic acid CAS Name: (E)-5-(4-acetyloxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-2-cycloheptyl-3-pentenoic acid IUPAC Name: (E)-5-(4-acetyloxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-2-cycloheptylpent-3-enoic acid Traditional Name: (E)-5-(4-acetoxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-2-cycloheptyl-pent-3-enoic acid Formula: C24H30O7 MolecularWeight: 430.4908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)OC(=O)C)CC=CC(C3CCCCCC3)C(=O)O)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)OC(=O)C)C/C=C/C(C3CCCCCC3)C(=O)O)OC

InChI

InChI=1S/C24H30O7/c1-14-19-13-30-24(28)20(19)22(31-15(2)25)18(21(14)29-3)12-8-11-17(23(26)27)16-9-6-4-5-7-10-16/h8,11,16-17H,4-7,9-10,12-13H2,1-3H3,(H,26,27)/b11-8+