(2R,7S)-7-hexyl-2-(3-oxidanylpropyl)oxepan-3-one

Systemtic Name: (2R,7S)-7-hexyl-2-(3-oxidanylpropyl)oxepan-3-one Openeye Name: (2R,7S)-7-hexyl-2-(3-hydroxypropyl)oxepan-3-one CAS Name: (2R,7S)-7-hexyl-2-(3-hydroxypropyl)-3-oxepanone IUPAC Name: (2R,7S)-7-hexyl-2-(3-hydroxypropyl)oxepan-3-one Traditional Name: (2R,7S)-7-hexyl-2-(3-hydroxypropyl)oxepan-3-one Formula: C15H28O3 MolecularWeight: 256.38102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCCC(=O)C(O1)CCCO

Isomeric SMILES

CCCCCC[C@H]1CCCC(=O)[C@H](O1)CCCO

InChI

InChI=1S/C15H28O3/c1-2-3-4-5-8-13-9-6-10-14(17)15(18-13)11-7-12-16/h13,15-16H,2-12H2,1H3/t13-,15+/m0/s1