4-[3-(4-fluorophenyl)-3-oxidanylidene-1-(1,2,3-triazol-1-yl)propyl]benzenecarbonitrile

Systemtic Name: 4-[3-(4-fluorophenyl)-3-oxidanylidene-1-(1,2,3-triazol-1-yl)propyl]benzenecarbonitrile Openeye Name: 4-[3-(4-fluorophenyl)-3-oxo-1-(triazol-1-yl)propyl]benzonitrile CAS Name: 4-[3-(4-fluorophenyl)-3-oxo-1-(1-triazolyl)propyl]benzonitrile IUPAC Name: 4-[3-(4-fluorophenyl)-3-oxo-1-(triazol-1-yl)propyl]benzonitrile Traditional Name: 4-[3-(4-fluorophenyl)-3-keto-1-(triazol-1-yl)propyl]benzonitrile Formula: C18H13FN4O MolecularWeight: 320.320423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(CC(=O)C2=CC=C(C=C2)F)N3C=CN=N3

Isomeric SMILES

C1=CC(=CC=C1C#N)C(CC(=O)C2=CC=C(C=C2)F)N3C=CN=N3

InChI

InChI=1S/C18H13FN4O/c19-16-7-5-15(6-8-16)18(24)11-17(23-10-9-21-22-23)14-3-1-13(12-20)2-4-14/h1-10,17H,11H2