2-[4-[2-oxidanyl-3-(4-phenylphenoxy)propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[2-oxidanyl-3-(4-phenylphenoxy)propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[2-hydroxy-3-(4-phenylphenoxy)propoxy]phenyl]acetonitrile CAS Name: 2-[4-[2-hydroxy-3-(4-phenylphenoxy)propoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[2-hydroxy-3-(4-phenylphenoxy)propoxy]phenyl]acetonitrile Traditional Name: 2-[4-[2-hydroxy-3-(4-phenylphenoxy)propoxy]phenyl]acetonitrile Formula: C23H21NO3 MolecularWeight: 359.41774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC(COC3=CC=C(C=C3)CC#N)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC(COC3=CC=C(C=C3)CC#N)O

InChI

InChI=1S/C23H21NO3/c24-15-14-18-6-10-22(11-7-18)26-16-21(25)17-27-23-12-8-20(9-13-23)19-4-2-1-3-5-19/h1-13,21,25H,14,16-17H2