2-[2,4-bis(2-methylbutan-2-yl)phenoxy]ethanenitrile

Systemtic Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]ethanenitrile Openeye Name: 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]acetonitrile CAS Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]acetonitrile IUPAC Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]acetonitrile Traditional Name: 2-(2,4-ditert-amylphenoxy)acetonitrile Formula: C18H27NO MolecularWeight: 273.41308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCC#N)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCC#N)C(C)(C)CC

InChI

InChI=1S/C18H27NO/c1-7-17(3,4)14-9-10-16(20-12-11-19)15(13-14)18(5,6)8-2/h9-10,13H,7-8,12H2,1-6H3