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

Systemtic Name: 3-hexyl-2-methyl-3-oxidanyl-isoindol-1-one Openeye Name: 3-hexyl-3-hydroxy-2-methyl-isoindolin-1-one CAS Name: 3-hexyl-3-hydroxy-2-methyl-1-isoindolone IUPAC Name: 3-hexyl-3-hydroxy-2-methylisoindol-1-one Traditional Name: 3-hexyl-3-hydroxy-2-methyl-isoindolin-1-one Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C2=CC=CC=C2C(=O)N1C)O

Isomeric SMILES

CCCCCCC1(C2=CC=CC=C2C(=O)N1C)O

InChI

InChI=1S/C15H21NO2/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,3-5,8,11H2,1-2H3