2-butoxy-5-(4-pentylphenyl)benzenecarbonitrile

Systemtic Name: 2-butoxy-5-(4-pentylphenyl)benzenecarbonitrile Openeye Name: 2-butoxy-5-(4-pentylphenyl)benzonitrile CAS Name: 2-butoxy-5-(4-pentylphenyl)benzonitrile IUPAC Name: 2-butoxy-5-(4-pentylphenyl)benzonitrile Traditional Name: 5-(4-amylphenyl)-2-butoxy-benzonitrile Formula: C22H27NO MolecularWeight: 321.45588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)OCCCC)C#N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)OCCCC)C#N

InChI

InChI=1S/C22H27NO/c1-3-5-7-8-18-9-11-19(12-10-18)20-13-14-22(21(16-20)17-23)24-15-6-4-2/h9-14,16H,3-8,15H2,1-2H3