2-tert-butyl-6-chloranyl-4-propyl-benzenecarbonitrile

Systemtic Name: 2-tert-butyl-6-chloranyl-4-propyl-benzenecarbonitrile Openeye Name: 2-tert-butyl-6-chloro-4-propyl-benzonitrile CAS Name: 2-tert-butyl-6-chloro-4-propylbenzonitrile IUPAC Name: 2-tert-butyl-6-chloro-4-propylbenzonitrile Traditional Name: 2-tert-butyl-6-chloro-4-propyl-benzonitrile Formula: C14H18ClN MolecularWeight: 235.75242

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1)Cl)C#N)C(C)(C)C

Isomeric SMILES

CCCC1=CC(=C(C(=C1)Cl)C#N)C(C)(C)C

InChI

InChI=1S/C14H18ClN/c1-5-6-10-7-12(14(2,3)4)11(9-16)13(15)8-10/h7-8H,5-6H2,1-4H3