3-ethynyl-2-methyl-3-oxidanyl-isoindol-1-one

Systemtic Name: 3-ethynyl-2-methyl-3-oxidanyl-isoindol-1-one Openeye Name: 3-ethynyl-3-hydroxy-2-methyl-isoindolin-1-one CAS Name: 3-ethynyl-3-hydroxy-2-methyl-1-isoindolone IUPAC Name: 3-ethynyl-3-hydroxy-2-methylisoindol-1-one Traditional Name: 3-ethynyl-3-hydroxy-2-methyl-isoindolin-1-one Formula: C11H9NO2 MolecularWeight: 187.19466

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C1(C#C)O

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C1(C#C)O

InChI

InChI=1S/C11H9NO2/c1-3-11(14)9-7-5-4-6-8(9)10(13)12(11)2/h1,4-7,14H,2H3