2-[(1R,2S)-2-ethanoyl-1-(4-oxidanylidenepentyl)cyclobutyl]ethanenitrile

Systemtic Name: 2-[(1R,2S)-2-ethanoyl-1-(4-oxidanylidenepentyl)cyclobutyl]ethanenitrile Openeye Name: 2-[(1R,2S)-2-acetyl-1-(4-oxopentyl)cyclobutyl]acetonitrile CAS Name: 2-[(1R,2S)-2-acetyl-1-(4-oxopentyl)cyclobutyl]acetonitrile IUPAC Name: 2-[(1R,2S)-2-acetyl-1-(4-oxopentyl)cyclobutyl]acetonitrile Traditional Name: 2-[(1R,2S)-2-acetyl-1-(4-ketopentyl)cyclobutyl]acetonitrile Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCC1(CCC1C(=O)C)CC#N

Isomeric SMILES

CC(=O)CCC[C@@]1(CC[C@@H]1C(=O)C)CC#N

InChI

InChI=1S/C13H19NO2/c1-10(15)4-3-6-13(8-9-14)7-5-12(13)11(2)16/h12H,3-8H2,1-2H3/t12-,13-/m1/s1