2-(4-fluorophenyl)-2-(pyridin-3-ylmethyl)-5-(1H-pyrrol-3-yl)pentanenitrile

Systemtic Name: 2-(4-fluorophenyl)-2-(pyridin-3-ylmethyl)-5-(1H-pyrrol-3-yl)pentanenitrile Openeye Name: 2-(4-fluorophenyl)-2-(3-pyridylmethyl)-5-(1H-pyrrol-3-yl)pentanenitrile CAS Name: 2-(4-fluorophenyl)-2-(3-pyridinylmethyl)-5-(1H-pyrrol-3-yl)pentanenitrile IUPAC Name: 2-(4-fluorophenyl)-2-(pyridin-3-ylmethyl)-5-(1H-pyrrol-3-yl)pentanenitrile Traditional Name: 2-(4-fluorophenyl)-2-(3-pyridylmethyl)-5-(1H-pyrrol-3-yl)valeronitrile Formula: C21H20FN3 MolecularWeight: 333.402003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC(CCCC2=CNC=C2)(C#N)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CN=C1)CC(CCCC2=CNC=C2)(C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3/c22-20-7-5-19(6-8-20)21(16-23,13-18-4-2-11-24-15-18)10-1-3-17-9-12-25-14-17/h2,4-9,11-12,14-15,25H,1,3,10,13H2