4-oxidanylidene-1-pentyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-oxidanylidene-1-pentyl-cyclohexane-1-carbonitrile Openeye Name: 4-oxo-1-pentyl-cyclohexanecarbonitrile CAS Name: 4-oxo-1-pentyl-1-cyclohexanecarbonitrile IUPAC Name: 4-oxo-1-pentylcyclohexane-1-carbonitrile Traditional Name: 1-amyl-4-keto-cyclohexanecarbonitrile Formula: C12H19NO MolecularWeight: 193.28536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CCC(=O)CC1)C#N

Isomeric SMILES

CCCCCC1(CCC(=O)CC1)C#N

InChI

InChI=1S/C12H19NO/c1-2-3-4-7-12(10-13)8-5-11(14)6-9-12/h2-9H2,1H3