5-(4-octylphenyl)-2-oxidanyl-benzenecarbonitrile

Systemtic Name: 5-(4-octylphenyl)-2-oxidanyl-benzenecarbonitrile Openeye Name: 2-hydroxy-5-(4-octylphenyl)benzonitrile CAS Name: 2-hydroxy-5-(4-octylphenyl)benzonitrile IUPAC Name: 2-hydroxy-5-(4-octylphenyl)benzonitrile Traditional Name: 2-hydroxy-5-(4-octylphenyl)benzonitrile Formula: C21H25NO MolecularWeight: 307.4293

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)O)C#N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)O)C#N

InChI

InChI=1S/C21H25NO/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)19-13-14-21(23)20(15-19)16-22/h9-15,23H,2-8H2,1H3