2,6-dimethyl-4-pentyl-benzenecarbonitrile

Systemtic Name: 2,6-dimethyl-4-pentyl-benzenecarbonitrile Openeye Name: 2,6-dimethyl-4-pentyl-benzonitrile CAS Name: 2,6-dimethyl-4-pentylbenzonitrile IUPAC Name: 2,6-dimethyl-4-pentylbenzonitrile Traditional Name: 4-amyl-2,6-dimethyl-benzonitrile Formula: C14H19N MolecularWeight: 201.30736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C(=C1)C)C#N)C

Isomeric SMILES

CCCCCC1=CC(=C(C(=C1)C)C#N)C

InChI

InChI=1S/C14H19N/c1-4-5-6-7-13-8-11(2)14(10-15)12(3)9-13/h8-9H,4-7H2,1-3H3