3,3-bis[3,5-bis(bromanyl)-4-methyl-phenyl]-2-benzofuran-1-one

Systemtic Name: 3,3-bis[3,5-bis(bromanyl)-4-methyl-phenyl]-2-benzofuran-1-one Openeye Name: 3,3-bis(3,5-dibromo-4-methyl-phenyl)isobenzofuran-1-one CAS Name: 3,3-bis(3,5-dibromo-4-methylphenyl)-1-isobenzofuranone IUPAC Name: 3,3-bis(3,5-dibromo-4-methylphenyl)-2-benzofuran-1-one Traditional Name: 3,3-bis(3,5-dibromo-4-methyl-phenyl)phthalide Formula: C22H14Br4O2 MolecularWeight: 629.96136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Br)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C(=C4)Br)C)Br)Br

Isomeric SMILES

CC1=C(C=C(C=C1Br)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C(=C4)Br)C)Br)Br

InChI

InChI=1S/C22H14Br4O2/c1-11-17(23)7-13(8-18(11)24)22(14-9-19(25)12(2)20(26)10-14)16-6-4-3-5-15(16)21(27)28-22/h3-10H,1-2H3