(2-bromanyl-4-phenyl-phenyl) 6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoate

Systemtic Name: (2-bromanyl-4-phenyl-phenyl) 6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoate Openeye Name: (2-bromo-4-phenyl-phenyl) 6-(1,3-dioxoisoindolin-2-yl)hexanoate CAS Name: 6-(1,3-dioxo-2-isoindolyl)hexanoic acid (2-bromo-4-phenylphenyl) ester IUPAC Name: (2-bromo-4-phenylphenyl) 6-(1,3-dioxoisoindol-2-yl)hexanoate Traditional Name: 6-phthalimidohexanoic acid (2-bromo-4-phenyl-phenyl) ester Formula: C26H22BrNO4 MolecularWeight: 492.36118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)CCCCCN3C(=O)C4=CC=CC=C4C3=O)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)CCCCCN3C(=O)C4=CC=CC=C4C3=O)Br

InChI

InChI=1S/C26H22BrNO4/c27-22-17-19(18-9-3-1-4-10-18)14-15-23(22)32-24(29)13-5-2-8-16-28-25(30)20-11-6-7-12-21(20)26(28)31/h1,3-4,6-7,9-12,14-15,17H,2,5,8,13,16H2