3-[2,2-bis(bromanyl)-3-[(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)methyl]-1-methyl-cyclopropyl]propanoic acid

Systemtic Name: 3-[2,2-bis(bromanyl)-3-[(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)methyl]-1-methyl-cyclopropyl]propanoic acid Openeye Name: 3-[2,2-dibromo-3-[(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)methyl]-1-methyl-cyclopropyl]propanoic acid CAS Name: 3-[2,2-dibromo-3-[(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)methyl]-1-methylcyclopropyl]propanoic acid IUPAC Name: 3-[2,2-dibromo-3-[(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)methyl]-1-methylcyclopropyl]propanoic acid Traditional Name: 3-[2,2-dibromo-3-[(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)methyl]-1-methyl-cyclopropyl]propionic acid Formula: C18H20Br2O6 MolecularWeight: 492.1558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC3C(C3(Br)Br)(C)CCC(=O)O)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)CC3C(C3(Br)Br)(C)CCC(=O)O)OC

InChI

InChI=1S/C18H20Br2O6/c1-8-10-7-26-16(24)13(10)14(23)9(15(8)25-3)6-11-17(2,18(11,19)20)5-4-12(21)22/h11,23H,4-7H2,1-3H3,(H,21,22)