3-hex-1-ynyl-2-methyl-3-oxidanyl-isoindol-1-one

Systemtic Name: 3-hex-1-ynyl-2-methyl-3-oxidanyl-isoindol-1-one Openeye Name: 3-hex-1-ynyl-3-hydroxy-2-methyl-isoindolin-1-one CAS Name: 3-hex-1-ynyl-3-hydroxy-2-methyl-1-isoindolone IUPAC Name: 3-hex-1-ynyl-3-hydroxy-2-methylisoindol-1-one Traditional Name: 3-hex-1-ynyl-3-hydroxy-2-methyl-isoindolin-1-one Formula: C15H17NO2 MolecularWeight: 243.30098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1(C2=CC=CC=C2C(=O)N1C)O

Isomeric SMILES

CCCCC#CC1(C2=CC=CC=C2C(=O)N1C)O

InChI

InChI=1S/C15H17NO2/c1-3-4-5-8-11-15(18)13-10-7-6-9-12(13)14(17)16(15)2/h6-7,9-10,18H,3-5H2,1-2H3