4-[4-(5-pentyloxan-2-yl)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(5-pentyloxan-2-yl)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(5-pentyltetrahydropyran-2-yl)phenyl]benzonitrile CAS Name: 4-[4-(5-pentyl-2-oxanyl)phenyl]benzonitrile IUPAC Name: 4-[4-(5-pentyloxan-2-yl)phenyl]benzonitrile Traditional Name: 4-[4-(5-amyltetrahydropyran-2-yl)phenyl]benzonitrile Formula: C23H27NO MolecularWeight: 333.46658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(OC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCC1CCC(OC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H27NO/c1-2-3-4-5-19-8-15-23(25-17-19)22-13-11-21(12-14-22)20-9-6-18(16-24)7-10-20/h6-7,9-14,19,23H,2-5,8,15,17H2,1H3