2-[4-(cyanomethyl)-2-(2-ethylhexoxy)-5-methoxy-phenyl]ethanenitrile

Systemtic Name: 2-[4-(cyanomethyl)-2-(2-ethylhexoxy)-5-methoxy-phenyl]ethanenitrile Openeye Name: 2-[4-(cyanomethyl)-2-(2-ethylhexoxy)-5-methoxy-phenyl]acetonitrile CAS Name: 2-[4-(cyanomethyl)-2-(2-ethylhexoxy)-5-methoxyphenyl]acetonitrile IUPAC Name: 2-[4-(cyanomethyl)-2-(2-ethylhexoxy)-5-methoxyphenyl]acetonitrile Traditional Name: 2-[4-(cyanomethyl)-2-(2-ethylhexoxy)-5-methoxy-phenyl]acetonitrile Formula: C19H26N2O2 MolecularWeight: 314.42194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=CC(=C(C=C1CC#N)OC)CC#N

Isomeric SMILES

CCCCC(CC)COC1=CC(=C(C=C1CC#N)OC)CC#N

InChI

InChI=1S/C19H26N2O2/c1-4-6-7-15(5-2)14-23-19-13-16(8-10-20)18(22-3)12-17(19)9-11-21/h12-13,15H,4-9,14H2,1-3H3