2-[2-(3,4-dimethoxyphenyl)ethylamino]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-6-fluoro-benzonitrile CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-6-fluorobenzonitrile IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-6-fluorobenzonitrile Traditional Name: 2-fluoro-6-(homoveratrylamino)benzonitrile Formula: C17H17FN2O2 MolecularWeight: 300.327483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=C(C(=CC=C2)F)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=C(C(=CC=C2)F)C#N)OC

InChI

InChI=1S/C17H17FN2O2/c1-21-16-7-6-12(10-17(16)22-2)8-9-20-15-5-3-4-14(18)13(15)11-19/h3-7,10,20H,8-9H2,1-2H3