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

Systemtic Name: 3-[2-(4-bromophenyl)ethynyl]-2-methyl-3-oxidanyl-isoindol-1-one Openeye Name: 3-[2-(4-bromophenyl)ethynyl]-3-hydroxy-2-methyl-isoindolin-1-one CAS Name: 3-[2-(4-bromophenyl)ethynyl]-3-hydroxy-2-methyl-1-isoindolone IUPAC Name: 3-[2-(4-bromophenyl)ethynyl]-3-hydroxy-2-methylisoindol-1-one Traditional Name: 3-[2-(4-bromophenyl)ethynyl]-3-hydroxy-2-methyl-isoindolin-1-one Formula: C17H12BrNO2 MolecularWeight: 342.18668

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C1(C#CC3=CC=C(C=C3)Br)O

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C1(C#CC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C17H12BrNO2/c1-19-16(20)14-4-2-3-5-15(14)17(19,21)11-10-12-6-8-13(18)9-7-12/h2-9,21H,1H3