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

Systemtic Name: (1-oxidanylidene-1-phenyl-butan-2-yl) 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]benzoate Openeye Name: 1-benzoylpropyl 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)benzoate CAS Name: 3-(5-bromo-1,3-dioxo-2-isoindolyl)benzoic acid (1-oxo-1-phenylbutan-2-yl) ester IUPAC Name: (1-oxo-1-phenylbutan-2-yl) 3-(5-bromo-1,3-dioxoisoindol-2-yl)benzoate Traditional Name: 3-(5-bromo-1,3-diketo-isoindolin-2-yl)benzoic acid 1-benzoylpropyl ester Formula: C25H18BrNO5 MolecularWeight: 492.31812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C25H18BrNO5/c1-2-21(22(28)15-7-4-3-5-8-15)32-25(31)16-9-6-10-18(13-16)27-23(29)19-12-11-17(26)14-20(19)24(27)30/h3-14,21H,2H2,1H3