4-[3-(2-phenethyl-5-phenylmethoxy-3H-1-benzofuran-2-yl)propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-(2-phenethyl-5-phenylmethoxy-3H-1-benzofuran-2-yl)propoxy]benzenecarbonitrile Openeye Name: 4-[3-(5-benzyloxy-2-phenethyl-3H-benzofuran-2-yl)propoxy]benzonitrile CAS Name: 4-[3-(2-phenethyl-5-phenylmethoxy-3H-benzofuran-2-yl)propoxy]benzonitrile IUPAC Name: 4-[3-(2-phenethyl-5-phenylmethoxy-3H-1-benzofuran-2-yl)propoxy]benzonitrile Traditional Name: 4-[3-(5-benzoxy-2-phenethyl-coumaran-2-yl)propoxy]benzonitrile Formula: C33H31NO3 MolecularWeight: 489.60414

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)OCC3=CC=CC=C3)OC1(CCCOC4=CC=C(C=C4)C#N)CCC5=CC=CC=C5

Isomeric SMILES

C1C2=C(C=CC(=C2)OCC3=CC=CC=C3)OC1(CCCOC4=CC=C(C=C4)C#N)CCC5=CC=CC=C5

InChI

InChI=1S/C33H31NO3/c34-24-27-12-14-30(15-13-27)35-21-7-19-33(20-18-26-8-3-1-4-9-26)23-29-22-31(16-17-32(29)37-33)36-25-28-10-5-2-6-11-28/h1-6,8-17,22H,7,18-21,23,25H2