2-[3,4-bis(1-phenylethoxy)phenyl]-4-(3-phenylmethoxyphenyl)butanenitrile

Systemtic Name: 2-[3,4-bis(1-phenylethoxy)phenyl]-4-(3-phenylmethoxyphenyl)butanenitrile Openeye Name: 4-(3-benzyloxyphenyl)-2-[3,4-bis(1-phenylethoxy)phenyl]butanenitrile CAS Name: 2-[3,4-bis(1-phenylethoxy)phenyl]-4-(3-phenylmethoxyphenyl)butanenitrile IUPAC Name: 2-[3,4-bis(1-phenylethoxy)phenyl]-4-(3-phenylmethoxyphenyl)butanenitrile Traditional Name: 4-(3-benzoxyphenyl)-2-[3,4-bis(1-phenylethoxy)phenyl]butyronitrile Formula: C39H37NO3 MolecularWeight: 567.71598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC2=C(C=C(C=C2)C(CCC3=CC(=CC=C3)OCC4=CC=CC=C4)C#N)OC(C)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=CC=C1)OC2=C(C=C(C=C2)C(CCC3=CC(=CC=C3)OCC4=CC=CC=C4)C#N)OC(C)C5=CC=CC=C5

InChI

InChI=1S/C39H37NO3/c1-29(33-16-8-4-9-17-33)42-38-24-23-35(26-39(38)43-30(2)34-18-10-5-11-19-34)36(27-40)22-21-31-15-12-20-37(25-31)41-28-32-13-6-3-7-14-32/h3-20,23-26,29-30,36H,21-22,28H2,1-2H3