(3S)-3-hept-1-ynyl-3-oxidanyl-2-phenyl-isoindol-1-one

Systemtic Name: (3S)-3-hept-1-ynyl-3-oxidanyl-2-phenyl-isoindol-1-one Openeye Name: (3S)-3-hept-1-ynyl-3-hydroxy-2-phenyl-isoindolin-1-one CAS Name: (3S)-3-hept-1-ynyl-3-hydroxy-2-phenyl-1-isoindolone IUPAC Name: (3S)-3-hept-1-ynyl-3-hydroxy-2-phenylisoindol-1-one Traditional Name: (3S)-3-hept-1-ynyl-3-hydroxy-2-phenyl-isoindolin-1-one Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1(C2=CC=CC=C2C(=O)N1C3=CC=CC=C3)O

Isomeric SMILES

CCCCCC#C[C@@]1(C2=CC=CC=C2C(=O)N1C3=CC=CC=C3)O

InChI

InChI=1S/C21H21NO2/c1-2-3-4-5-11-16-21(24)19-15-10-9-14-18(19)20(23)22(21)17-12-7-6-8-13-17/h6-10,12-15,24H,2-5H2,1H3/t21-/m0/s1