2-(4-tert-butylphenyl)-2-pyrrolidin-1-yl-ethanenitrile

Systemtic Name: 2-(4-tert-butylphenyl)-2-pyrrolidin-1-yl-ethanenitrile Openeye Name: 2-(4-tert-butylphenyl)-2-pyrrolidin-1-yl-acetonitrile CAS Name: 2-(4-tert-butylphenyl)-2-(1-pyrrolidinyl)acetonitrile IUPAC Name: 2-(4-tert-butylphenyl)-2-pyrrolidin-1-ylacetonitrile Traditional Name: 2-(4-tert-butylphenyl)-2-pyrrolidino-acetonitrile Formula: C16H22N2 MolecularWeight: 242.35928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C#N)N2CCCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(C#N)N2CCCC2

InChI

InChI=1S/C16H22N2/c1-16(2,3)14-8-6-13(7-9-14)15(12-17)18-10-4-5-11-18/h6-9,15H,4-5,10-11H2,1-3H3