7-(2-ethyl-5-phenylmethoxy-phenoxy)-2-phenyl-heptanenitrile

Systemtic Name: 7-(2-ethyl-5-phenylmethoxy-phenoxy)-2-phenyl-heptanenitrile Openeye Name: 7-(5-benzyloxy-2-ethyl-phenoxy)-2-phenyl-heptanenitrile CAS Name: 7-(2-ethyl-5-phenylmethoxyphenoxy)-2-phenylheptanenitrile IUPAC Name: 7-(2-ethyl-5-phenylmethoxyphenoxy)-2-phenylheptanenitrile Traditional Name: 7-(5-benzoxy-2-ethyl-phenoxy)-2-phenyl-enanthonitrile Formula: C28H31NO2 MolecularWeight: 413.55124

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)OCC2=CC=CC=C2)OCCCCCC(C#N)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C=C(C=C1)OCC2=CC=CC=C2)OCCCCCC(C#N)C3=CC=CC=C3

InChI

InChI=1S/C28H31NO2/c1-2-24-17-18-27(31-22-23-12-6-3-7-13-23)20-28(24)30-19-11-5-10-16-26(21-29)25-14-8-4-9-15-25/h3-4,6-9,12-15,17-18,20,26H,2,5,10-11,16,19,22H2,1H3