2-cyclohexyl-3-pentyl-benzenecarbonitrile

Systemtic Name: 2-cyclohexyl-3-pentyl-benzenecarbonitrile Openeye Name: 2-cyclohexyl-3-pentyl-benzonitrile CAS Name: 2-cyclohexyl-3-pentylbenzonitrile IUPAC Name: 2-cyclohexyl-3-pentylbenzonitrile Traditional Name: 3-amyl-2-cyclohexyl-benzonitrile Formula: C18H25N MolecularWeight: 255.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC(=C1C2CCCCC2)C#N

Isomeric SMILES

CCCCCC1=CC=CC(=C1C2CCCCC2)C#N

InChI

InChI=1S/C18H25N/c1-2-3-5-9-16-12-8-13-17(14-19)18(16)15-10-6-4-7-11-15/h8,12-13,15H,2-7,9-11H2,1H3