2-methyl-2-[(4-phenylmethoxyphenoxy)methyl]hexanenitrile

Systemtic Name: 2-methyl-2-[(4-phenylmethoxyphenoxy)methyl]hexanenitrile Openeye Name: 2-[(4-benzyloxyphenoxy)methyl]-2-methyl-hexanenitrile CAS Name: 2-methyl-2-[(4-phenylmethoxyphenoxy)methyl]hexanenitrile IUPAC Name: 2-methyl-2-[(4-phenylmethoxyphenoxy)methyl]hexanenitrile Traditional Name: 2-[(4-benzoxyphenoxy)methyl]-2-methyl-hexanenitrile Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(COC1=CC=C(C=C1)OCC2=CC=CC=C2)C#N

Isomeric SMILES

CCCCC(C)(COC1=CC=C(C=C1)OCC2=CC=CC=C2)C#N

InChI

InChI=1S/C21H25NO2/c1-3-4-14-21(2,16-22)17-24-20-12-10-19(11-13-20)23-15-18-8-6-5-7-9-18/h5-13H,3-4,14-15,17H2,1-2H3