3-[2-(4-bromophenyl)ethynyl]-3-oxidanyl-2-phenyl-isoindol-1-one

Systemtic Name: 3-[2-(4-bromophenyl)ethynyl]-3-oxidanyl-2-phenyl-isoindol-1-one Openeye Name: 3-[2-(4-bromophenyl)ethynyl]-3-hydroxy-2-phenyl-isoindolin-1-one CAS Name: 3-[2-(4-bromophenyl)ethynyl]-3-hydroxy-2-phenyl-1-isoindolone IUPAC Name: 3-[2-(4-bromophenyl)ethynyl]-3-hydroxy-2-phenylisoindol-1-one Traditional Name: 3-[2-(4-bromophenyl)ethynyl]-3-hydroxy-2-phenyl-isoindolin-1-one Formula: C22H14BrNO2 MolecularWeight: 404.25606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C2(C#CC4=CC=C(C=C4)Br)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C2(C#CC4=CC=C(C=C4)Br)O

InChI

InChI=1S/C22H14BrNO2/c23-17-12-10-16(11-13-17)14-15-22(26)20-9-5-4-8-19(20)21(25)24(22)18-6-2-1-3-7-18/h1-13,26H