2-[2-[(3,5-ditert-butylphenoxy)methyl]phenyl]ethanenitrile

Systemtic Name: 2-[2-[(3,5-ditert-butylphenoxy)methyl]phenyl]ethanenitrile Openeye Name: 2-[2-[(3,5-ditert-butylphenoxy)methyl]phenyl]acetonitrile CAS Name: 2-[2-[(3,5-ditert-butylphenoxy)methyl]phenyl]acetonitrile IUPAC Name: 2-[2-[(3,5-ditert-butylphenoxy)methyl]phenyl]acetonitrile Traditional Name: 2-[2-[(3,5-ditert-butylphenoxy)methyl]phenyl]acetonitrile Formula: C23H29NO MolecularWeight: 335.48246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO/c1-22(2,3)19-13-20(23(4,5)6)15-21(14-19)25-16-18-10-8-7-9-17(18)11-12-24/h7-10,13-15H,11,16H2,1-6H3