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5-tert-butyl-2-ethyl-benzenecarbonitrile

5-tert-butyl-2-ethyl-benzenecarbonitrile

Systemtic Name:5-tert-butyl-2-ethyl-benzenecarbonitrile
Openeye Name:5-tert-butyl-2-ethyl-benzonitrile
CAS Name:5-tert-butyl-2-ethylbenzonitrile
IUPAC Name:5-tert-butyl-2-ethylbenzonitrile
Traditional Name:5-tert-butyl-2-ethyl-benzonitrile
Formula: C13H17N
MolecularWeight: 187.28078
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(C)(C)C)C#N


Isomeric SMILES

CCC1=C(C=C(C=C1)C(C)(C)C)C#N


InChI

InChI=1S/C13H17N/c1-5-10-6-7-12(13(2,3)4)8-11(10)9-14/h6-8H,5H2,1-4H3


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