(2S,7S)-7-pentyl-2-prop-2-enyl-oxepane-2-carbonitrile

Systemtic Name: (2S,7S)-7-pentyl-2-prop-2-enyl-oxepane-2-carbonitrile Openeye Name: (2S,7S)-2-allyl-7-pentyl-oxepane-2-carbonitrile CAS Name: (2S,7S)-7-pentyl-2-prop-2-enyl-2-oxepanecarbonitrile IUPAC Name: (2S,7S)-7-pentyl-2-prop-2-enyloxepane-2-carbonitrile Traditional Name: (2S,7S)-2-allyl-7-amyl-oxepane-2-carbonitrile Formula: C15H25NO MolecularWeight: 235.3651

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCCCC(O1)(CC=C)C#N

Isomeric SMILES

CCCCC[C@H]1CCCC[C@](O1)(CC=C)C#N

InChI

InChI=1S/C15H25NO/c1-3-5-6-9-14-10-7-8-12-15(13-16,17-14)11-4-2/h4,14H,2-3,5-12H2,1H3/t14-,15+/m0/s1