3-[[(4-ethoxy-3-methoxy-phenyl)methyl-ethyl-amino]methyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[[(4-ethoxy-3-methoxy-phenyl)methyl-ethyl-amino]methyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[[(4-ethoxy-3-methoxy-phenyl)methyl-ethyl-amino]methyl]-4-fluoro-benzonitrile CAS Name: 3-[[(4-ethoxy-3-methoxyphenyl)methyl-ethylamino]methyl]-4-fluorobenzonitrile IUPAC Name: 3-[[(4-ethoxy-3-methoxyphenyl)methyl-ethylamino]methyl]-4-fluorobenzonitrile Traditional Name: 3-[[(4-ethoxy-3-methoxy-benzyl)-ethyl-amino]methyl]-4-fluoro-benzonitrile Formula: C20H23FN2O2 MolecularWeight: 342.407223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OCC)OC)CC2=C(C=CC(=C2)C#N)F

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OCC)OC)CC2=C(C=CC(=C2)C#N)F

InChI

InChI=1S/C20H23FN2O2/c1-4-23(14-17-10-15(12-22)6-8-18(17)21)13-16-7-9-19(25-5-2)20(11-16)24-3/h6-11H,4-5,13-14H2,1-3H3