2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-6-fluoro-benzonitrile CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-6-fluorobenzonitrile IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-6-fluorobenzonitrile Traditional Name: 2-fluoro-6-[homoveratryl(methyl)amino]benzonitrile Formula: C18H19FN2O2 MolecularWeight: 314.354063

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C2=C(C(=CC=C2)F)C#N

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C2=C(C(=CC=C2)F)C#N

InChI

InChI=1S/C18H19FN2O2/c1-21(16-6-4-5-15(19)14(16)12-20)10-9-13-7-8-17(22-2)18(11-13)23-3/h4-8,11H,9-10H2,1-3H3