5-[3-(4-fluorophenyl)prop-1-ynyl]-2-(pyridin-4-ylmethyl)-3H-isoindol-1-one

Systemtic Name: 5-[3-(4-fluorophenyl)prop-1-ynyl]-2-(pyridin-4-ylmethyl)-3H-isoindol-1-one Openeye Name: 5-[3-(4-fluorophenyl)prop-1-ynyl]-2-(4-pyridylmethyl)isoindolin-1-one CAS Name: 5-[3-(4-fluorophenyl)prop-1-ynyl]-2-(pyridin-4-ylmethyl)-3H-isoindol-1-one IUPAC Name: 5-[3-(4-fluorophenyl)prop-1-ynyl]-2-(pyridin-4-ylmethyl)-3H-isoindol-1-one Traditional Name: 5-[3-(4-fluorophenyl)prop-1-ynyl]-2-(4-pyridylmethyl)isoindolin-1-one Formula: C23H17FN2O MolecularWeight: 356.392283

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C#CCC3=CC=C(C=C3)F)C(=O)N1CC4=CC=NC=C4

Isomeric SMILES

C1C2=C(C=CC(=C2)C#CCC3=CC=C(C=C3)F)C(=O)N1CC4=CC=NC=C4

InChI

InChI=1S/C23H17FN2O/c24-21-7-4-17(5-8-21)2-1-3-18-6-9-22-20(14-18)16-26(23(22)27)15-19-10-12-25-13-11-19/h4-14H,2,15-16H2