4-[4-[2-(4-bromanyl-3-methyl-phenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]oxyphenoxy]benzoate

Systemtic Name: 4-[4-[2-(4-bromanyl-3-methyl-phenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]oxyphenoxy]benzoate Openeye Name: 4-[4-[2-(4-bromo-3-methyl-phenyl)-1,3-dioxo-isoindolin-5-yl]oxyphenoxy]benzoate CAS Name: 4-[4-[[2-(4-bromo-3-methylphenyl)-1,3-dioxo-5-isoindolyl]oxy]phenoxy]benzoate IUPAC Name: 4-[4-[2-(4-bromo-3-methylphenyl)-1,3-dioxoisoindol-5-yl]oxyphenoxy]benzoate Traditional Name: 4-[4-[2-(4-bromo-3-methyl-phenyl)-1,3-diketo-isoindolin-5-yl]oxyphenoxy]benzoate Formula: C28H17BrNO6- MolecularWeight: 543.34168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)OC5=CC=C(C=C5)C(=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)OC5=CC=C(C=C5)C(=O)[O-])Br

InChI

InChI=1S/C28H18BrNO6/c1-16-14-18(4-13-25(16)29)30-26(31)23-12-11-22(15-24(23)27(30)32)36-21-9-7-20(8-10-21)35-19-5-2-17(3-6-19)28(33)34/h2-15H,1H3,(H,33,34)/p-1