1-[2-(4-cyano-3-fluoranyl-phenoxy)ethanoyl]-4-[(4-fluorophenyl)methyl]piperidine-4-carbonitrile

Systemtic Name: 1-[2-(4-cyano-3-fluoranyl-phenoxy)ethanoyl]-4-[(4-fluorophenyl)methyl]piperidine-4-carbonitrile Openeye Name: 1-[2-(4-cyano-3-fluoro-phenoxy)acetyl]-4-[(4-fluorophenyl)methyl]piperidine-4-carbonitrile CAS Name: 1-[2-(4-cyano-3-fluorophenoxy)-1-oxoethyl]-4-[(4-fluorophenyl)methyl]-4-piperidinecarbonitrile IUPAC Name: 1-[2-(4-cyano-3-fluorophenoxy)acetyl]-4-[(4-fluorophenyl)methyl]piperidine-4-carbonitrile Traditional Name: 1-[2-(4-cyano-3-fluoro-phenoxy)acetyl]-4-(4-fluorobenzyl)isonipecotonitrile Formula: C22H19F2N3O2 MolecularWeight: 395.401966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC2=CC=C(C=C2)F)C#N)C(=O)COC3=CC(=C(C=C3)C#N)F

Isomeric SMILES

C1CN(CCC1(CC2=CC=C(C=C2)F)C#N)C(=O)COC3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C22H19F2N3O2/c23-18-4-1-16(2-5-18)12-22(15-26)7-9-27(10-8-22)21(28)14-29-19-6-3-17(13-25)20(24)11-19/h1-6,11H,7-10,12,14H2