2-(4-fluorophenyl)-2-(pyrimidin-5-ylmethyl)pentanenitrile

Systemtic Name: 2-(4-fluorophenyl)-2-(pyrimidin-5-ylmethyl)pentanenitrile Openeye Name: 2-(4-fluorophenyl)-2-(pyrimidin-5-ylmethyl)pentanenitrile CAS Name: 2-(4-fluorophenyl)-2-(5-pyrimidinylmethyl)pentanenitrile IUPAC Name: 2-(4-fluorophenyl)-2-(pyrimidin-5-ylmethyl)pentanenitrile Traditional Name: 2-(4-fluorophenyl)-2-(5-pyrimidylmethyl)valeronitrile Formula: C16H16FN3 MolecularWeight: 269.316743

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CN=CN=C1)(C#N)C2=CC=C(C=C2)F

Isomeric SMILES

CCCC(CC1=CN=CN=C1)(C#N)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H16FN3/c1-2-7-16(11-18,8-13-9-19-12-20-10-13)14-3-5-15(17)6-4-14/h3-6,9-10,12H,2,7-8H2,1H3