7-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxy-phenoxy]-2-phenyl-heptanenitrile

Systemtic Name: 7-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxy-phenoxy]-2-phenyl-heptanenitrile Openeye Name: 7-[5-benzyloxy-2-ethyl-4-(4-fluorophenyl)phenoxy]-2-phenyl-heptanenitrile CAS Name: 7-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxyphenoxy]-2-phenylheptanenitrile IUPAC Name: 7-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxyphenoxy]-2-phenylheptanenitrile Traditional Name: 7-[5-benzoxy-2-ethyl-4-(4-fluorophenyl)phenoxy]-2-phenyl-enanthonitrile Formula: C34H34FNO2 MolecularWeight: 507.637663

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C2=CC=C(C=C2)F)OCC3=CC=CC=C3)OCCCCCC(C#N)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(C=C(C(=C1)C2=CC=C(C=C2)F)OCC3=CC=CC=C3)OCCCCCC(C#N)C4=CC=CC=C4

InChI

InChI=1S/C34H34FNO2/c1-2-27-22-32(29-17-19-31(35)20-18-29)34(38-25-26-12-6-3-7-13-26)23-33(27)37-21-11-5-10-16-30(24-36)28-14-8-4-9-15-28/h3-4,6-9,12-15,17-20,22-23,30H,2,5,10-11,16,21,25H2,1H3