2-(4-bromophenyl)-4-(3-fluorophenyl)-2-(pyridin-3-ylmethyl)butanenitrile

Systemtic Name: 2-(4-bromophenyl)-4-(3-fluorophenyl)-2-(pyridin-3-ylmethyl)butanenitrile Openeye Name: 2-(4-bromophenyl)-4-(3-fluorophenyl)-2-(3-pyridylmethyl)butanenitrile CAS Name: 2-(4-bromophenyl)-4-(3-fluorophenyl)-2-(3-pyridinylmethyl)butanenitrile IUPAC Name: 2-(4-bromophenyl)-4-(3-fluorophenyl)-2-(pyridin-3-ylmethyl)butanenitrile Traditional Name: 2-(4-bromophenyl)-4-(3-fluorophenyl)-2-(3-pyridylmethyl)butyronitrile Formula: C22H18BrFN2 MolecularWeight: 409.294123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CCC(CC2=CN=CC=C2)(C#N)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)F)CCC(CC2=CN=CC=C2)(C#N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H18BrFN2/c23-20-8-6-19(7-9-20)22(16-25,14-18-4-2-12-26-15-18)11-10-17-3-1-5-21(24)13-17/h1-9,12-13,15H,10-11,14H2