2-octan-2-ylbenzenecarbonitrile

Systemtic Name: 2-octan-2-ylbenzenecarbonitrile Openeye Name: 2-(1-methylheptyl)benzonitrile CAS Name: 2-octan-2-ylbenzonitrile IUPAC Name: 2-octan-2-ylbenzonitrile Traditional Name: 2-(1-methylheptyl)benzonitrile Formula: C15H21N MolecularWeight: 215.33394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C1=CC=CC=C1C#N

Isomeric SMILES

CCCCCCC(C)C1=CC=CC=C1C#N

InChI

InChI=1S/C15H21N/c1-3-4-5-6-9-13(2)15-11-8-7-10-14(15)12-16/h7-8,10-11,13H,3-6,9H2,1-2H3