4-[4-(2-oxidanyl-3-phenoxy-propoxy)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(2-oxidanyl-3-phenoxy-propoxy)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(2-hydroxy-3-phenoxy-propoxy)phenyl]benzonitrile CAS Name: 4-[4-(2-hydroxy-3-phenoxypropoxy)phenyl]benzonitrile IUPAC Name: 4-[4-(2-hydroxy-3-phenoxypropoxy)phenyl]benzonitrile Traditional Name: 4-[4-(2-hydroxy-3-phenoxy-propoxy)phenyl]benzonitrile Formula: C22H19NO3 MolecularWeight: 345.39116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)O

Isomeric SMILES

C1=CC=C(C=C1)OCC(COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C22H19NO3/c23-14-17-6-8-18(9-7-17)19-10-12-22(13-11-19)26-16-20(24)15-25-21-4-2-1-3-5-21/h1-13,20,24H,15-16H2