2-[8-[3,5-bis(bromanyl)-4-phenyl-phenoxy]octyl]isoindole-1,3-dione

Systemtic Name: 2-[8-[3,5-bis(bromanyl)-4-phenyl-phenoxy]octyl]isoindole-1,3-dione Openeye Name: 2-[8-(3,5-dibromo-4-phenyl-phenoxy)octyl]isoindoline-1,3-dione CAS Name: 2-[8-(3,5-dibromo-4-phenylphenoxy)octyl]isoindole-1,3-dione IUPAC Name: 2-[8-(3,5-dibromo-4-phenylphenoxy)octyl]isoindole-1,3-dione Traditional Name: 2-[8-(3,5-dibromo-4-phenyl-phenoxy)octyl]isoindoline-1,3-quinone Formula: C28H27Br2NO3 MolecularWeight: 585.32688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2Br)OCCCCCCCCN3C(=O)C4=CC=CC=C4C3=O)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2Br)OCCCCCCCCN3C(=O)C4=CC=CC=C4C3=O)Br

InChI

InChI=1S/C28H27Br2NO3/c29-24-18-21(19-25(30)26(24)20-12-6-5-7-13-20)34-17-11-4-2-1-3-10-16-31-27(32)22-14-8-9-15-23(22)28(31)33/h5-9,12-15,18-19H,1-4,10-11,16-17H2