2-(4-fluorophenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile

Systemtic Name: 2-(4-fluorophenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile Openeye Name: 2-(4-fluorophenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile CAS Name: 2-(4-fluorophenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile IUPAC Name: 2-(4-fluorophenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile Traditional Name: 2-(4-fluorophenyl)-2-(1,2,4-triazol-1-ylmethyl)valeronitrile Formula: C14H15FN4 MolecularWeight: 258.294103

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CN1C=NC=N1)(C#N)C2=CC=C(C=C2)F

Isomeric SMILES

CCCC(CN1C=NC=N1)(C#N)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H15FN4/c1-2-7-14(8-16,9-19-11-17-10-18-19)12-3-5-13(15)6-4-12/h3-6,10-11H,2,7,9H2,1H3