2-[4-[2,3-di(nonoxy)propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[2,3-di(nonoxy)propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[2,3-di(nonoxy)propoxy]phenyl]acetonitrile CAS Name: 2-[4-[2,3-di(nonoxy)propoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[2,3-di(nonoxy)propoxy]phenyl]acetonitrile Traditional Name: 2-[4-[2,3-di(nonoxy)propoxy]phenyl]acetonitrile Formula: C29H49NO3 MolecularWeight: 459.70426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOCC(COC1=CC=C(C=C1)CC#N)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCOCC(COC1=CC=C(C=C1)CC#N)OCCCCCCCCC

InChI

InChI=1S/C29H49NO3/c1-3-5-7-9-11-13-15-23-31-25-29(32-24-16-14-12-10-8-6-4-2)26-33-28-19-17-27(18-20-28)21-22-30/h17-20,29H,3-16,21,23-26H2,1-2H3