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

Systemtic Name: 2-[2-[[2,4-bis(2-methylbutan-2-yl)phenoxy]methyl]phenyl]ethanenitrile Openeye Name: 2-[2-[[2,4-bis(1,1-dimethylpropyl)phenoxy]methyl]phenyl]acetonitrile CAS Name: 2-[2-[[2,4-bis(2-methylbutan-2-yl)phenoxy]methyl]phenyl]acetonitrile IUPAC Name: 2-[2-[[2,4-bis(2-methylbutan-2-yl)phenoxy]methyl]phenyl]acetonitrile Traditional Name: 2-[2-[(2,4-ditert-amylphenoxy)methyl]phenyl]acetonitrile Formula: C25H33NO MolecularWeight: 363.53562

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2CC#N)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2CC#N)C(C)(C)CC

InChI

InChI=1S/C25H33NO/c1-7-24(3,4)21-13-14-23(22(17-21)25(5,6)8-2)27-18-20-12-10-9-11-19(20)15-16-26/h9-14,17H,7-8,15,18H2,1-6H3