3-(2,2-dimethylpropyl)benzenecarbonitrile

Systemtic Name: 3-(2,2-dimethylpropyl)benzenecarbonitrile Openeye Name: 3-(2,2-dimethylpropyl)benzonitrile CAS Name: 3-(2,2-dimethylpropyl)benzonitrile IUPAC Name: 3-(2,2-dimethylpropyl)benzonitrile Traditional Name: 3-neopentylbenzonitrile Formula: C12H15N MolecularWeight: 173.2542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=CC=CC(=C1)C#N

Isomeric SMILES

CC(C)(C)CC1=CC=CC(=C1)C#N

InChI

InChI=1S/C12H15N/c1-12(2,3)8-10-5-4-6-11(7-10)9-13/h4-7H,8H2,1-3H3