3-hexyl-3-(2-phenylmethoxyheptyl)oxetan-2-one

Systemtic Name: 3-hexyl-3-(2-phenylmethoxyheptyl)oxetan-2-one Openeye Name: 3-(2-benzyloxyheptyl)-3-hexyl-oxetan-2-one CAS Name: 3-hexyl-3-(2-phenylmethoxyheptyl)-2-oxetanone IUPAC Name: 3-hexyl-3-(2-phenylmethoxyheptyl)oxetan-2-one Traditional Name: 3-(2-benzoxyheptyl)-3-hexyl-oxetan-2-one Formula: C23H36O3 MolecularWeight: 360.53014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(COC1=O)CC(CCCCC)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCC1(COC1=O)CC(CCCCC)OCC2=CC=CC=C2

InChI

InChI=1S/C23H36O3/c1-3-5-7-12-16-23(19-26-22(23)24)17-21(15-9-6-4-2)25-18-20-13-10-8-11-14-20/h8,10-11,13-14,21H,3-7,9,12,15-19H2,1-2H3